- Class: 2
- Architecture: 2.40:Beta Barrel
- Topology: 2.40.70:Cathepsin D, subunit A; domain 1
- Homology: 2.40.70.10:Acid Proteases
PDB Entries
PDB ID | OPM | Mutant | Chain Formula | Resolution | HETNAM | |||
---|---|---|---|---|---|---|---|---|
Amino Acid sequence | SCOPe Family Level | CATH Homology Level | ||||||
1a30 | [A2][a] | [A2][a] | [A2][a] | 2 | ||||
1a8g | [A2] | [A2] | [A2] | 2.5 | 2Z4:BENZYL [(1R)-1-({(1S,2S,3S)-1-BENZYL-2-HYDROXY-4-({(1S)-1-[(2-HYDROXY-4-METHOXYBENZYL)CARBAMOYL]-2-METHYLPROPYL}AMINO)-3-[(4-METHOXYBENZYL)AMINO]-4-OXOBUTYL}CARBAMOYL)-2,2-DIMETHYLPROPYL]CARBAMATE | |||
1a8k | [A2] | [A2] | [A2] | 2 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE | |||
1a94 | [A2] | [A2] | [A2] | 2 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE | |||
1a9m | [A2] | [A2] | [A2] | 2.3 | U0E:N-[[1-[N-ACETAMIDYL]-[1-CYCLOHEXYLMETHYL-2-HYDROXY-4-ISOPROPYL]-BUT-4-YL]-CARBONYL]-GLUTAMINYL-ARGINYL-AMIDE | |||
1aaq | [A2] | [A2] | [A2] | 2.5 | PSI:METHYL N-{(4S,5S)-5-[(L-ALANYL-L-ALANYL)AMINO]-4-HYDROXY-6-PHENYLHEXANOYL}-L-VALYL-L-VALINATE | |||
1aid | [A2] | [A2] | [A2] | 2.2 | CL:CHLORIDE ION THK:4-(4-CHLORO-PHENYL)-1-{3-[2-(4-FLUORO-PHENYL)-[1,3]DITHIOLAN-2-YL]-PROPYL}-PIPERIDIN-4-OL | |||
1ajv | [A2] | [A2] | [A2] | 2 | NMB:2,7-DIBENZYL-1,1-DIOXO-3,6-BIS-PHENOXYMETHYL-[1,2,7]THIADIAZEPANE-4,5-DIOL | |||
1ajx | [A2] | [A2] | [A2] | 2 | AH1:AHA001 | |||
1am5 | [A] | [A] | [A] | 2.16 | ||||
1apt | [A][a] | [A][a] | [A][a] | 1.8 | IVA:ISOVALERIC ACID LTA:4,8-DIAMINO-3-HYDROXY-OCTANOIC ACID ETHYL ESTER MAN:ALPHA-D-MANNOPYRANOSE | |||
1apu | [A][a] | [A][a] | [A][a] | 1.8 | 32L:ETHYL (3S,4S)-4-AMINO-3-HYDROXY-6-METHYLHEPTANOATE IVA:ISOVALERIC ACID MAN:ALPHA-D-MANNOPYRANOSE | |||
1apv | [A][a] | [A][a] | [A][a] | 1.8 | DFO:2,2-DIFLUORO-3-HYDROSTATINE DMF:DIMETHYLFORMAMIDE IVA:ISOVALERIC ACID MAN:ALPHA-D-MANNOPYRANOSE NME:METHYLAMINE SO4:SULFATE ION XYS:ALPHA-D-XYLOPYRANOSE | |||
1apw | [A][a] | [A][a] | [A][a] | 1.8 | DFI:2,2-DIFLUOROSTATINE DMF:DIMETHYLFORMAMIDE HSY:ALPHA-L-XYLOPYRANOSE IVA:ISOVALERIC ACID MAN:ALPHA-D-MANNOPYRANOSE NME:METHYLAMINE SO4:SULFATE ION | |||
1avf | [A][a] | [A][a] | [A][a] | 2.36 | NA:SODIUM ION | |||
1axa | [A2] | [A2] | [A2] | 2 | U0E:N-[[1-[N-ACETAMIDYL]-[1-CYCLOHEXYLMETHYL-2-HYDROXY-4-ISOPROPYL]-BUT-4-YL]-CARBONYL]-GLUTAMINYL-ARGINYL-AMIDE | |||
1az5 | [A2] | [A2] | [A2] | 2 | ||||
1b11 | [A2] | [A2] | [A2] | 1.9 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE SO4:SULFATE ION | |||
1b5f | [A2B2] | [A2B2] | [A4] | 1.72 | BMA:BETA-D-MANNOPYRANOSE FUC:ALPHA-L-FUCOPYRANOSE MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
1b6j | [A2][a] | [A2][a] | [A2][a] | 1.85 | ABA:ALPHA-AMINOBUTYRIC ACID NH2:AMINO GROUP RTY:4-{4-[(2S,3R)-2-AMINO-4-BROMO-3-HYDROXYBUTYL]PHENOXY}BUTANOIC ACID SO4:SULFATE ION | |||
1b6k | [A2] | [A2] | [A2] | 1.85 | ABA:ALPHA-AMINOBUTYRIC ACID PI5:N-[3-(8-SEC-BUTYL-7,10-DIOXO-2-OXA-6,9-DIAZA-BICYCLO[11.2.2]HEPTADECA-1(16),13(17),14- TRIEN-11-YLAMINO)-2-HYDROXY-1-(4-HYDROXY-BENZYL)-PROPYL]-3-METHYL-2- (2-OXO-PYRROLIDIN-1-YL)-BUTYRAMIDE SO4:SULFATE ION | |||
1b6l | [A2] | [A2] | [A2] | 1.75 | ABA:ALPHA-AMINOBUTYRIC ACID PI4:1-[2-(8-CARBAMOYLMETHYL-6,9-DIOXO-2-OXA-7,10-DIAZA-BICYCLO[11.2.2]HEPTADECA- 1(16),13(17),14-TRIEN-11-YL)-2-HYDROXY-ETHYL]-PIPERIDINE-2-CARBOXYLIC ACIDTERT-BUTYLAMIDE SO4:SULFATE ION | |||
1b6m | [A2] | [A2] | [A2] | 1.85 | ABA:ALPHA-AMINOBUTYRIC ACID PI6:[1-BENZYL-3-(8-SEC-BUTYL-7,10-DIOXO-2-OXA-6,9-DIAZA-BICYCLO[11.2.2] HEPTADECA-1(16),13(17),14-TRIEN-11-YLAMINO)-2-HYDROXY-PROPYL]-CARBAMIC ACID TERT-BUTYLESTER SO4:SULFATE ION | |||
1b6p | [A2] | [A2] | [A2] | 2 | ABA:ALPHA-AMINOBUTYRIC ACID PI7:N-[3-(8-SEC-BUTYL-7,10-DIOXO-2-OXA-6,9-DIAZA-BICYCLO[11.2.2] HEPTADECA-1(16),13(17),14-TRIEN-11-YAMINO)-2-HYDROXY-1-(4-HYDROXY-BENZYL) -PROPYL]-3-METHYL-2-PROPIONYLAMINO-BUTYRAMIDE SO4:SULFATE ION | |||
1bai | [A2] | [A2] | [A2] | 2.4 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE | |||
1bbs | [A] | [A] | [A] | 2.8 | ||||
1bdl | [A2] | [A2] | [A2] | 2.8 | IM1:(2R,4S,5S,1___sq___S)-2-PHENYLMETHYL-4-HYDROXY-5-(TERT-BUTOXYCARBONYL)AMINO-6-PHENYL HEXANOYL-N-(1___sq___-IMIDAZO-2-YL)-2___sq___-METHYLPROPANAMIDE | |||
1bdq | [A2] | [A2] | [A2] | 2.5 | IM1:(2R,4S,5S,1___sq___S)-2-PHENYLMETHYL-4-HYDROXY-5-(TERT-BUTOXYCARBONYL)AMINO-6-PHENYL HEXANOYL-N-(1___sq___-IMIDAZO-2-YL)-2___sq___-METHYLPROPANAMIDE | |||
1bdr | [A2] | [A2] | [A2] | 2.8 | IM1:(2R,4S,5S,1___sq___S)-2-PHENYLMETHYL-4-HYDROXY-5-(TERT-BUTOXYCARBONYL)AMINO-6-PHENYL HEXANOYL-N-(1___sq___-IMIDAZO-2-YL)-2___sq___-METHYLPROPANAMIDE | |||
1bil | [A2] | [A2] | [A2] | 2.4 | 0IU:(2S)-2-[(2-AMINO-1,3-THIAZOL-4-YL)METHYL]-N~1~-[(1S,2R,3R)-1-(CYCLOHEXYLMETHYL)-2,3-DIHYDROXY-5-METHYLHEXYL]-N~4~-[2-(D IMETHYLAMINO)-2-OXOETHYL]-N~4~-[(1S)-1-PHENYLETHYL]BUTANEDIAMIDE | |||
1bim | [A2] | [A2] | [A2] | 2.8 | 0QB:(2S)-2-[(2-AMINO-1,3-THIAZOL-4-YL)METHYL]-N~1~-{(1S,2S)-1-(CYCLOHEXYLMETHYL)-2-HYDROXY-2-[(3R)-1,5,5-TRIMETHYL-2-OXOPYRROLIDIN-3-YL]ETHYL}-N~4~-[2-(DIMETHYLAMINO)-2-OXOETHYL]-N~4~-[(1S)-1-PHENYLETHYL]BUTANEDIAMIDE | |||
1bv7 | [A2] | [A2] | [A2] | 2 | XV6:[4R-(4ALPHA,5ALPHA,6BETA,7BETA)]-3,3___sq___-[[TETRAHYDRO-5,6-DIHYDROXY-2-OXO-4,7-BIS(PHENYLMETHYL)-1H-1,3-DIAZEPINE-1,3(2H)-D IYL] BIS(METHYLENE)]BIS[N-2-THIAZOLYLBENZAMIDE] | |||
1bv9 | [A2] | [A2] | [A2] | 2 | XV6:[4R-(4ALPHA,5ALPHA,6BETA,7BETA)]-3,3___sq___-[[TETRAHYDRO-5,6-DIHYDROXY-2-OXO-4,7-BIS(PHENYLMETHYL)-1H-1,3-DIAZEPINE-1,3(2H)-D IYL] BIS(METHYLENE)]BIS[N-2-THIAZOLYLBENZAMIDE] | |||
1bve | [A2] | [A2] | [A2] | NOTAPPLICABLE. | DMP:[4-R-(-4-ALPHA,5-ALPHA,6-BETA,7-BETA)]-HEXAHYDRO-5,6-BIS(HYDROXY)-[1,3-BIS([4-HYDROXYMETHYL-PHENYL]METHYL)-4,7-BIS(PHEN YLMETHYL)]-2H-1,3-DIAZEPINONE | |||
1bvg | [A2] | [A2] | [A2] | NOTAPPLICABLE. | DMP:[4-R-(-4-ALPHA,5-ALPHA,6-BETA,7-BETA)]-HEXAHYDRO-5,6-BIS(HYDROXY)-[1,3-BIS([4-HYDROXYMETHYL-PHENYL]METHYL)-4,7-BIS(PHEN YLMETHYL)]-2H-1,3-DIAZEPINONE | |||
1bwa | [A2] | [A2] | [A2] | 1.9 | XV6:[4R-(4ALPHA,5ALPHA,6BETA,7BETA)]-3,3___sq___-[[TETRAHYDRO-5,6-DIHYDROXY-2-OXO-4,7-BIS(PHENYLMETHYL)-1H-1,3-DIAZEPINE-1,3(2H)-D IYL] BIS(METHYLENE)]BIS[N-2-THIAZOLYLBENZAMIDE] | |||
1bwb | [A2] | [A2] | [A2] | 1.8 | 146:[4R-(4ALPHA,5ALPHA,6ALPHA,7ALPHA)]-3,3___sq___-{{TETRAHYDRO-5,6-DIHYDROXY-2-OXO-4,7-BIS(PHENYLMETHYL)-1H-1,3-DIAZEPINE-1,3(2H)-DIYL]BIS(METHYLENE)]BIS[N-1H-BENZIMIDAZOL-2-YLBENZAMIDE] | |||
1bxo | [A] | [A] | [A] | 0.95 | GOL:GLYCEROL MAN:ALPHA-D-MANNOPYRANOSE PP7:METHYL CYCLO[(2S)-2-[[(1R)-1-(N-(L-N-(3-METHYLBUTANOYL)VALYL-L-ASPARTYL)AMINO)-3-METHYLBUTYL]HYDROXYPHOSPHINYLOXY]-3-(3-AMINOMETHYL)PHENYLPROPANOATE SO4:SULFATE ION | |||
1bxq | [A] | [A] | [A] | 1.41 | ACT:ACETATE ION GOL:GLYCEROL MAN:ALPHA-D-MANNOPYRANOSE PP8:2-[(1R)-1-(N-(3-METHYLBUTANOYL)-L-VALYL-L-ASPARAGINYL)-AMINO)-3-METHYLBUTYL]HYDROXYPHOSPHINYLOXY]-3-PHENYLPROPANOIC ACID METHYLESTER SO4:SULFATE ION | |||
1c6x | [A2] | [A2] | [A2] | 2.5 | 3IN:N-[2(S)-CYCLOPENTYL-1(R)-HYDROXY-3(R)METHYL]-5-[(2(S)-TERTIARY-BUTYLAMINO-CARBONYL)-4-(N1-(2)-(N-METHYLPIPERAZINYL)-3-CHLORO-PYRAZINYL-5-CARBONYL)-PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYL-PENTANAMIDE | |||
1c6y | [A2] | [A2] | [A2] | 2.5 | MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE | |||
1c6z | [A2] | [A2] | [A2] | 2.5 | ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
1c70 | [A2] | [A2] | [A2] | 2.5 | L75:N-[2(R)-HYDROXY-1(S)-INDANYL]-2(R)-PHENYLMETHYL-4(S)-HYDROXY-5-[4-[2-BENZOFURANYLMETHYL]-2(S)-[TERT-BUTYLAMINOCARBONYL]-PIPERAZINYL]-PENTANEAMIDE | |||
1cms | [A] | [A] | [A] | 2.3 | ||||
1cpi | [A2][a] | [A2][a] | [A2][a] | 2.05 | ABA:ALPHA-AMINOBUTYRIC ACID NH2:AMINO GROUP RTY:4-{4-[(2S,3R)-2-AMINO-4-BROMO-3-HYDROXYBUTYL]PHENOXY}BUTANOIC ACID SO4:SULFATE ION | |||
1czi | [A][a] | [A][a] | [A][a] | 2.3 | NOR:CYCLOHEXYL-NORSTATINE PHI:IODO-PHENYLALANINE SMC:S-METHYLCYSTEINE | |||
1d4h | [A2] | [A2] | [A2] | 1.81 | BEH:2,5-DIBENZYLOXY-3,4-DIHYDROXY-HEXANEDIOIC ACIDBENZYLAMIDE (2-HYDROXY-INDAN-1-YL)-AMIDE | |||
1d4i | [A2] | [A2] | [A2] | 1.81 | BEG:2,5-DIBENZYLOXY-3-HYDROXY-HEXANEDIOIC ACID BIS-[(2-HYDROXY-INDAN-1-YL)-AMIDE] | |||
1d4j | [A2] | [A2] | [A2] | 1.81 | MSC:2,5-DIBENZYLOXY-3,4-DIHYDROXY-HEXANEDIOIC ACID 2-CHLORO-6-FLUORO-BENZYLAMIDE (2-HYDROXY-INDAN-1- YL)-AMIDE | |||
1d4k | [A2] | [A2] | [A2] | 1.85 | ABA:ALPHA-AMINOBUTYRIC ACID PI8:N-13-[(10S,13S)-9,12-DIOXO-10-(2-BUTYL)-2-OXA-8,11-DIAZABICYCLO [13.2.2] NONADECA-15,17,18-TRIENE] (2R)-BENZYL-(4S)-HYDROXY-5-AMINOPENTANOIC (1R)-HYDROXY-(2S)-INDANEAMIDE SO4:SULFATE ION | |||
1d4l | [A2] | [A2] | [A2] | 1.75 | ABA:ALPHA-AMINOBUTYRIC ACID PI9:(10S,13S,1___sq___R)-13-[1___sq___-HYDROXY-2___sq___-(N-P-AMINOBENZENESULFONYL-1___sq______sq___-AMINO-3___sq______sq___-METHYLBUTYL)ETHYL]-8,11-DIOXO-10-ISOPROPYL-2-OXA-9,12-DIAZABICYCLO[13.2.2]NONADECA-15,17,18-TRIENE SO4:SULFATE ION | |||
1d4s | [A2] | [A2] | [A2] | 2.5 | TPV:N-(3-{(1R)-1-[(6R)-4-HYDROXY-2-OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO-2H-PYRAN-3-YL]PROPYL}PHENYL)-5-(TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE | |||
1d4y | [A2] | [A2] | [A2] | 1.97 | TPV:N-(3-{(1R)-1-[(6R)-4-HYDROXY-2-OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO-2H-PYRAN-3-YL]PROPYL}PHENYL)-5-(TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE | |||
1daz | [A2] | [A2] | [A2] | 1.55 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE | |||
1dif | [A2] | [A2] | [A2] | 1.7 | A85:N-{1-BENZYL-2,2-DIFLUORO-3,3-DIHYDROXY-4-[3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRYLAMINO]-5-PHENYL-PENTYL}-3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRAMIDE BME:BETA-MERCAPTOETHANOL | |||
1dmp | [A2] | [A2] | [A2] | 2 | CSO:S-HYDROXYCYSTEINE DMQ:[4-R-(-4-ALPHA,5-ALPHA,6-BETA,7-BETA)]-HEXAHYDRO-5,6-BIS(HYDROXY)-1,3-BIS([(3-AMINO)PHENYL]METHYL)-4,7-BIS(PHENYLMETHYL)-2H-1,3-DIAZEPINONE | |||
1dp5 | [AB] | [AB] | [AB] | 2.2 | BMA:BETA-D-MANNOPYRANOSE MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
1dpj | [AB] | [AB] | [AB] | 1.8 | BMA:BETA-D-MANNOPYRANOSE MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
1dw6 | [A2] | [A2] | [A2] | 1.88 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE | |||
1e5o | [A] | [A] | [A] | 2.05 | 3AI:N-[(2S)-2-AMINO-3-PHENYLPROPYL]-D-METHIONYL-L-ALANYL-L-ISOLEUCINE | |||
1e80 | [A] | [A] | [A] | 2.05 | 0GQ:4-AMINO-N-{(1R,8R,9R,13R)-16-(4-AMINO-2-METHYLPYRIMIDIN-5-YL)-1-BENZYL-8-(CYCLOHEXYLMETHYL)-9-HYDROXY-13-[(1S)-1-METHYLPROPYL]-2,6,11,14-TETRAOXO-3,7,12,15-TETRAAZAHEXADEC-1-YL}PIPERIDINE-1-CARBOXAMIDE | |||
1e81 | [A] | [A] | [A] | 2.05 | M91:(2S)-1-{[(2R)-1-{[(2S,3S)-1-CYCLOHEXYL-3-HYDROXY-4-(2-OXOPYRIDIN-1(2H)-YL)BUTAN-2-YL]AMINO}-3-(METHYLSULFANYL)-1-OXOPROPAN-2-YL]AMINO}-1-OXO-3-PHENYLPROPAN-2-YL 4-AMINOPIPERIDINE-1-CARBOXYLATE | |||
1e82 | [A] | [A] | [A] | 2.05 | M90:(2S)-1-{[(2R)-1-{[(2S,3R)-1-CYCLOHEXYL-3-HYDROXY-4-(PYRIDIN-4-YLOXY)BUTAN-2-YL]AMINO}-3-(METHYLSULFANYL)-1-OXOPROPAN-2-YL]AMINO}-1-OXO-3-PHENYLPROPAN-2-YL 4-AMINOPIPERIDINE-1-CARBOXYLATE | |||
1eag | [A2] | [A2] | [A2] | 2.1 | A70:N-ETHYL-N-[(4-METHYLPIPERAZIN-1-YL)CARBONYL]-D-PHENYLALANYL-N-[(1S,2S,4R)-4-(BUTYLCARBAMOYL)-1-(CYCLOHEXYLMETHYL)-2-HYDROXY-5-METHYLHEXYL]-L-NORLEUCINAMIDE | |||
1ebk | [A2] | [A2] | [A2] | 2.06 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE | |||
1ebw | [A2] | [A2] | [A2] | 1.81 | BEI:N,N-[2,5-O-[DIBENZYL]-GLUCARYL]-DI-[ISOLEUCYL-AMIDO-METHANE] | |||
1eby | [A2] | [A2] | [A2] | 2.29 | BEB:N,N-[2,5-O-DIBENZYL-GLUCARYL]-DI-[1-AMINO-INDAN-2-OL] | |||
1ebz | [A2] | [A2] | [A2] | 2.01 | BEC:[5-(2-HYDROXY-INDAN-1-YLCARBAMOYL)-3,4-DIHYDROXY-2,5-[DIBENZYL-OXY]-PENTANOYL]-VALINYL-AMIDO-METHANE | |||
1ec0 | [A2] | [A2] | [A2] | 1.79 | BED:N,N-[2,5-O-DI-2-FLUORO-BENZYL-GLUCARYL]-DI-[1-AMINO-INDAN-2-OL] | |||
1ec1 | [A2] | [A2] | [A2] | 2.1 | BEE:N,N-[2,5-O-[DI-4-THIOPHEN-3-YL-BENZYL]-GLUCARYL]-DI-[VALYL-AMIDO-METHANE] | |||
1ec2 | [A2] | [A2] | [A2] | 2 | BEJ:N,N-[2,5-O-[DI-4-PYRIDIN-3-YL-BENZYL]-GLUCARYL]-DI-[VALYL-AMIDO-METHANE] | |||
1ec3 | [A2] | [A2] | [A2] | 1.8 | MS3:N,N-[2,5-O-DIBENZYL-GLUCARYL]-DI-[VALINYL-AMINOMETHANYL-PYRIDINE] | |||
1eed | [A] | [A] | [A] | 2 | 0EO:(2S)-2-[[(3S,4S)-5-CYCLOHEXYL-4-[[(4S,5S)-5-[(2-METHYLPROPAN-2-YL)OXYCARBONYLAMINO]-4-OXIDANYL-6-PHENYL-HEXANOYL]AMINO]-3-OXIDANYL-PENTANOYL]AMINO]-4-METHYL-PENTANOIC ACID | |||
1ent | [A] | [A] | [A] | 1.9 | 0EM:N-(TERT-BUTOXYCARBONYL)-L-PHENYLALANYL-N-{(1S)-1-[(R)-HYDROXY(2-{[(2S)-2-METHYLBUTYL]AMINO}-2-OXOETHYL)PHOSPHORYL]-3-METHYLBUTYL}-3-(1H-IMIDAZOL-3-IUM-4-YL)-L-ALANINAMIDE SO4:SULFATE ION | |||
1epl | [A][a] | [A][a] | [A][a] | 2 | PSA:3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID | |||
1epm | [A][a] | [A][a] | [A][a] | 1.6 | PSA:3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID SO4:SULFATE ION | |||
1epn | [A] | [A] | [A] | 1.6 | 2ZS:N-(MORPHOLIN-4-YLCARBONYL)-L-PHENYLALANYL-N-[(1R,2S)-1-(CYCLOHEXYLMETHYL)-2-HYDROXY-3-(1-METHYLETHOXY)-3-OXOPROPYL]-S-METHYL-L-CYSTEINAMIDE SO4:SULFATE ION | |||
1epo | [A] | [A] | [A] | 2 | 2Z3:N-(MORPHOLIN-4-YLCARBONYL)-L-PHENYLALANYL-N-[(1R)-1-(CYCLOHEXYLMETHYL)-3,3-DIFLUORO-2,2-DIHYDROXY-4-(METHYLAMINO)-4-OXOBUTYL]-L-NORLEUCINAMIDE | |||
1epp | [A] | [A] | [A] | 1.9 | 1Z1:N-(DIMETHYLSULFAMOYL)-L-PHENYLALANYL-N-[(1S,2S)-2-HYDROXY-4-{[(2S)-2-METHYLBUTYL]AMINO}-1-(2-METHYLPROPYL)-4-OXOBUTYL]-N~6~-(METHYLCARBAMOTHIOYL)-L-LYSINAMIDE SO4:SULFATE ION | |||
1epq | [A] | [A] | [A] | 1.9 | 0QF:N-[(1S)-2-{[(2S,3R,4S)-1-CYCLOHEXYL-3,4-DIHYDROXY-6-METHYLHEPTAN-2-YL]AMINO}-1-(ETHYLSULFANYL)-2-OXOETHYL]-NALPHA-(MORPHOLIN-4-YLSULFONYL)-L-PHENYLALANINAMIDE SO4:SULFATE ION | |||
1epr | [A] | [A] | [A] | 2.3 | 0QS:N~2~-[(2R)-2-BENZYL-3-(TERT-BUTYLSULFONYL)PROPANOYL]-N-{(1R)-1-(CYCLOHEXYLMETHYL)-3,3-DIFLUORO-2,2-DIHYDROXY-4-[(2-MORPHOLIN-4-YLETHYL)AMINO]-4-OXOBUTYL}-3-(1H-IMIDAZOL-3-IUM-4-YL)-L-ALANINAMIDE DGN:D-GLUTAMINE | |||
1er8 | [A][a] | [A][a] | [A][a] | 2 | DHI:D-HISTIDINE | |||
1f34 | [AB] | [AB] | [AB] | 2.45 | MPD:(4S)-2-METHYL-2,4-PENTANEDIOL SEP:PHOSPHOSERINE | |||
1f7a | [A2][a] | [A2][a] | [A2][a] | 2 | ACT:ACETATE ION | |||
1fb7 | [A2] | [A2] | [A2] | 2.6 | ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1 -PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
1fej | [A2] | [A2] | [A2] | 1.78 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE | |||
1ff0 | [A2] | [A2] | [A2] | 1.85 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE | |||
1fff | [A2] | [A2] | [A2] | 1.9 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE | |||
1ffi | [A2] | [A2] | [A2] | 1.7 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE | |||
1fg6 | [A2] | [A2] | [A2] | 1.8 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE | |||
1fg8 | [A2] | [A2] | [A2] | 1.85 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE | |||
1fgc | [A2] | [A2] | [A2] | 1.9 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE | |||
1fiv | [A2][a2] | [A2][a2] | [A2][a2] | 2 | ACE:ACETYL GROUP ALN:NAPHTHALEN-2-YL-3-ALANINE NH2:AMINO GROUP STA:STATINE | |||
1fkn | [A][a] | [A][a] | [A][a] | 1.9 | 1OL:(2R,4S,5S)-5-AMINO-4-HYDROXY-2,7-DIMETHYLOCTANOIC ACID | |||
1flh | [A] | [A] | [A] | 2.45 | ||||
1fmb | [A2] | [A2] | [A2] | 1.8 | HYB:[2-(2-METHYL-PROPANE-2-SULFONYLMETHYL)-3-NAPHTHALEN-1-YL-PROPIONYL-VALINYL]-PHENYLALANINOL | |||
1fmu | [A] | [A] | [A] | 2.7 | MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE NDG:2-ACETAMIDO-2-DEOXY-ALPHA-D-GLUCOPYRANOSE | |||
1fmx | [A] | [A] | [A] | 2.61 | BMA:BETA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
1fq4 | [A] | [A] | [A] | 2.7 | 2Y2:N-[(2R)-1-{[(2S,3R,5R)-1-CYCLOHEXYL-3-HYDROXY-5-{[2-(MORPHOLIN-4-YL)ETHYL]CARBAMOYL}OCT-7-YN-2-YL]AMINO}-3-(METHYLSULFA NYL)-1-OXOPROPAN-2-YL]-1H-BENZIMIDAZOLE-2-CARBOXAMIDE BGC:BETA-D-GLUCOPYRANOSE BMA:BETA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
1fq5 | [A] | [A] | [A] | 2.4 | 0GM:N-[(5S,9S,10S,13S)-9-HYDROXY-5,10-BIS(2-METHYLPROPYL)-4,7,12,16-TETRAOXO-3,6,11,17-TETRAAZABICYCLO[17.3.1]TRICOSA-1(23),19,21-TRIEN-13-YL]-3-(NAPHTHALEN-1-YL)-2-(NAPHTHALEN-1-YLMETHYL)PROPANAMIDE BMA:BETA-D-MANNOPYRANOSE MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
1fq6 | [A] | [A] | [A] | 2.7 | 0QF:N-[(1S)-2-{[(2S,3R,4S)-1-CYCLOHEXYL-3,4-DIHYDROXY-6-METHYLHEPTAN-2-YL]AMINO}-1-(ETHYLSULFANYL)-2-OXOETHYL]-NALPHA-(MORP HOLIN-4-YLSULFONYL)-L-PHENYLALANINAMIDE BMA:BETA-D-MANNOPYRANOSE GUP:ALPHA-L-GULOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
1fq7 | [A] | [A] | [A] | 2.8 | 2Y3:N-(TERT-BUTOXYCARBONYL)-L-PHENYLALANYL-N-[(2S,3S,5R)-1-CYCLOHEXYL-3-HYDROXY-7-METHYL-5-(METHYLCARBAMOYL)OCTAN-2-YL]-L-HISTIDINAMIDE BMA:BETA-D-MANNOPYRANOSE KBG:BETA-D-ARABINO-HEXOPYRANOS-2-ULOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
1fq8 | [A] | [A] | [A] | 2.8 | 2Y4:N-[(2S)-1-[[(2S)-1-[[(2S,3R)-1-CYCLOHEXYL-4,4-DIFLUORO-3-HYDROXY-5-(METHYLAMINO)-5-OXO-PENTAN-2-YL]AMINO]-1-OXO-HEXAN-2 -YL]AMINO]-1-OXO-3-PHENYL-PROPAN-2-YL]MORPHOLINE-4-CARBOXAMIDE BMA:BETA-D-MANNOPYRANOSE MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
1fqx | [A2] | [A2] | [A2] | 3.1 | 0ZT:N-{(2S,3S)-3-[(TERT-BUTOXYCARBONYL)AMINO]-2-HYDROXY-4-PHENYLBUTYL}-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-PHENYLALANINAMIDE | |||
1g0v | [AB] | [AB] | [AB] | 2 | BMA:BETA-D-MANNOPYRANOSE MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
1g2k | [A2] | [A2] | [A2] | 1.95 | NM1:3-(7-BENZYL-4,5-DIHYDROXY-1,1-DIOXO-3,6-BIS-PHENOXYMETHYL-1L6-[1,2,7]THIADIAZEPAN-2-YLMETHYL)-N-METHYL-BENZAMIDE | |||
1g35 | [A2] | [A2] | [A2] | 1.8 | AHF:2-[4-(HYDROXY-METHOXY-METHYL)-BENZYL]-7-(4-HYDROXYMETHYL-BENZYL)-1,1-DIOXO-3,6-BIS-PHENOXYMETHYL-1LAMBDA6-[1,2,7]THIADIAZEPANE-4,5-DIOL | |||
1g6l | [A] | [A] | [A] | 1.9 | ||||
1gkt | [A][a] | [A][a] | [A][a] | 2.1 | BOC:TERT-BUTYL HYDROGEN CARBONATE LOV:5-AMINO-4-HYDROXY-2-ISOPROPYL-7-METHYL-OCTANOIC ACID SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
1gnm | [A2] | [A2] | [A2] | 2.3 | U0E:N-[[1-[N-ACETAMIDYL]-[1-CYCLOHEXYLMETHYL-2-HYDROXY-4-ISOPROPYL]-BUT-4-YL]-CARBONYL]-GLUTAMINYL-ARGINYL-AMIDE | |||
1gnn | [A2] | [A2] | [A2] | 2.3 | U0E:N-[[1-[N-ACETAMIDYL]-[1-CYCLOHEXYLMETHYL-2-HYDROXY-4-ISOPROPYL]-BUT-4-YL]-CARBONYL]-GLUTAMINYL-ARGINYL-AMIDE | |||
1gno | [A2] | [A2] | [A2] | 2.3 | U0E:N-[[1-[N-ACETAMIDYL]-[1-CYCLOHEXYLMETHYL-2-HYDROXY-4-ISOPROPYL]-BUT-4-YL]-CARBONYL]-GLUTAMINYL-ARGINYL-AMIDE | |||
1gvt | [A] | [A] | [A] | 0.98 | 2ZS:N-(MORPHOLIN-4-YLCARBONYL)-L-PHENYLALANYL-N-[(1R,2S)-1-(CYCLOHEXYLMETHYL)-2-HYDROXY-3-(1-METHYLETHOXY)-3-OXOPROPYL]-S-METHYL-L-CYSTEINAMIDE SO4:SULFATE ION SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
1gvu | [A][a] | [A][a] | [A][a] | 0.94 | SO4:SULFATE ION STA:STATINE SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
1gvv | [A] | [A] | [A] | 1.05 | 0GM:N-[(5S,9S,10S,13S)-9-HYDROXY-5,10-BIS(2-METHYLPROPYL)-4,7,12,16-TETRAOXO-3,6,11,17-TETRAAZABICYCLO[17.3.1]TRICOSA-1(23),19,21-TRIEN-13-YL]-3-(NAPHTHALEN-1-YL)-2-(NAPHTHALEN-1-YLMETHYL)PROPANAMIDE SO4:SULFATE ION SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
1gvw | [A] | [A] | [A] | 1 | 0EM:N-(TERT-BUTOXYCARBONYL)-L-PHENYLALANYL-N-{(1S)-1-[(R)-HYDROXY(2-{[(2S)-2-METHYLBUTYL]AMINO}-2-OXOETHYL)PHOSPHORYL]-3-METHYLBUTYL}-3-(1H-IMIDAZOL-3-IUM-4-YL)-L-ALANINAMIDE SO4:SULFATE ION SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
1gvx | [A][a] | [A][a] | [A][a] | 1 | PUK:N-[(2S)-2-AMINO-3-PHENYLPROPYL]-L-PHENYLALANINE SO4:SULFATE ION SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
1hbv | [A2] | [A2] | [A2] | 2.3 | GAN:2-[3-BENZYL-5-(1-ALANYL-AMINOETHYL)-2,3,6,7-TETRAHYDRO-1H-AZEPIN-1-YL]-1-OXOPROPYL-VALINYL-VALINE-METHYLESTER | |||
1hef | [A2][a2] | [A2][a2] | [A2][a2] | 2.2 | PJJ:(2R,4S,5S)-5-AMINO-2-BENZYL-4-HYDROXY-6-PHENYLHEXANOICACID VME:METHYL L-VALINATE | |||
1heg | [A2] | [A2] | [A2] | 2.2 | PSI:METHYL N-{(4S,5S)-5-[(L-ALANYL-L-ALANYL)AMINO]-4-HYDROXY-6-PHENYLHEXANOYL}-L-VALYL-L-VALINATE | |||
1hhp | [A2] | [A2] | [A2] | 2.7 | ||||
1hih | [A2] | [A2] | [A2] | 2.2 | BME:BETA-MERCAPTOETHANOL C20:ACETYL-NH-VAL-CYCLOHEXYL-CH2[NCH2CHOH]CH2-BENZYL-VAL-NH-ACETYL | |||
1hii | [A2] | [A2] | [A2] | 2.3 | C20:ACETYL-NH-VAL-CYCLOHEXYL-CH2[NCH2CHOH]CH2-BENZYL-VAL-NH-ACETYL SO4:SULFATE ION | |||
1hiv | [A2] | [A2] | [A2] | 2 | 1ZK:4-[(2R)-3-{[(1S,2S,3R,4S)-1-(CYCLOHEXYLMETHYL)-2,3-DIHYDROXY-5-METHYL-4-({(1S,2R)-2-METHYL-1-[(PYRIDIN-2-YLMETHYL)CARBAMOYL]BUTYL}CARBAMOYL)HEXYL]AMINO}-2-{[(NAPHTHALEN-1-YLOXY)ACETYL]AMINO}-3-OXOPROPYL]-1H-IMIDAZOL-3-IUM CSO:S-HYDROXYCYSTEINE | |||
1hos | [A2] | [A2] | [A2] | 2.3 | PHP:(2-PHENYL-1-CARBOBENZYL-OXYVALYL-AMINO)-ETHYL-PHOSPHINIC ACID | |||
1hpo | [A2] | [A2] | [A2] | 2.5 | UNI:4-CYANO-N-(3-CYCLOPROPYL(5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY-2-OXO-CYCLOOCTA[B]PYRAN-3-YL)METHYL)PHENYLBENZENSULFONAMIDE | |||
1hps | [A2] | [A2] | [A2] | 2.3 | RUN:2-[(1R,3S,4S)-1-BENZYL-4-[N-(BENZYLOXYCARBONYL)-L-VALYL]AMINO-3-PHENYLPENTYL]-4(5)-(2-METHYLPROPIONYL)IMIDAZOLE | |||
1hpv | [A2] | [A2] | [A2] | 1.9 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER | |||
1hpx | [A2] | [A2] | [A2] | 2 | KNI:(4R)-N-TERT-BUTYL-3-[(2S,3S)-2-HYDROXY-3-({N-[(ISOQUINOLIN-5-YLOXY)ACETYL]-S-METHYL-L-CYSTEINYL}AMINO)-4-PHENYLBUTANOYL]-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
1hrn | [A2] | [A2] | [A2] | 1.8 | 03D:(2R,4S,5S)-N-[(2S,3R,4S)-1-CYCLOHEXYL-3,4-DIHYDROXY-6-METHYLHEPTAN-2-YL]-2-(CYCLOPROPYLMETHYL)-4,5-DIHYDROXY-6-PHENYLHEXANAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
1hsg | [A2] | [A2] | [A2] | 2 | MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE | |||
1hsh | [A2] | [A2] | [A2] | 1.9 | MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE | |||
1hsi | [A2] | [A2] | [A2] | 2.5 | ||||
1hte | [A2][a] | [A2][a] | [A2][a] | 2.8 | G23:(2R,4S)-2-[(R)-BENZYLCARBAMOYL-PHENYLACETYL-METHYL]-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID | |||
1htf | [A2] | [A2] | [A2] | 2.2 | G26:2-(BENZYLCARBAMOYL-PHENYLACETYLAMINO-METHYL)-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID(HYDROXYMETHYL-2-PHENYLETHYL)AMIDE | |||
1htg | [A2] | [A2] | [A2] | 2 | G37:2-(BENZYLCARBAMOYL-PHENYLACETYLAMINO-METHYL)-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID 3-[(1H-BENZIMIDAZOL-2-YLMETHYLCARBAMOYL)-1-BENZYL-2-HYDROXYPROPYL]-AMIDE | |||
1htr | [A2B2] | [A2B2] | [A2B2] | 1.62 | ||||
1hvc | [A] | [A] | [A] | 1.8 | A79:N-{1-BENZYL-(2S,3S)-2,3-DIHYDROXY-4-[3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRYLAMINO]-5-PHENYL-PENTYL}-3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRAMIDE | |||
1hvh | [A2] | [A2] | [A2] | 1.8 | Q82:{[4-R(-4-ALPHA,5-ALPHA,6-BETA,7-BETA)]-HEXAHYDRO-5,6-BIS(HYDROXY)-1,3-BIS(4-HYDROXYMETHYL)METHYL]-4,7-BIS(PHENYLMETHYL)-2H-1,3-DIAZEPIN-2-YLIDENE]CYANAMIDE} | |||
1hvi | [A2] | [A2] | [A2] | 1.8 | A77:N-{1-BENZYL-(2R,3S)-2,3-DIHYDROXY-4-[3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRYLAMINO]-5-PHENYL-PENTYL}-3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRAMIDE | |||
1hvj | [A2] | [A2] | [A2] | 2 | A78:N-{1-BENZYL-3-HYDROXY-4-[3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRYLAMINO]-5-PHENYL-PENTYL}-3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRAMIDE | |||
1hvk | [A2] | [A2] | [A2] | 1.8 | A79:N-{1-BENZYL-(2S,3S)-2,3-DIHYDROXY-4-[3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRYLAMINO]-5-PHENYL-PENTYL}-3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRAMIDE | |||
1hvl | [A2] | [A2] | [A2] | 1.8 | A76:N-{1-BENZYL-(2R,3R)-2,3-DIHYDROXY-4-[3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRYLAMINO]-5-PHENYL-PENTYL}-3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRAMIDE | |||
1hvr | [A2] | [A2] | [A2] | 1.8 | CSO:S-HYDROXYCYSTEINE XK2:[4R-(4ALPHA,5ALPHA,6BETA,7BETA)]-HEXAHYDRO-5,6-DIHYDROXY-1,3-BIS[2-NAPHTHYL-METHYL]-4,7-BIS(PHENYLMETHYL)-2H-1,3-DIAZEPIN-2-ONE | |||
1hvs | [A2] | [A2] | [A2] | 2.25 | A77:N-{1-BENZYL-(2R,3S)-2,3-DIHYDROXY-4-[3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRYLAMINO]-5-PHENYL-PENTYL}-3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRAMIDE | |||
1hwr | [A2] | [A2] | [A2] | 1.8 | 216:[4-R-(4-ALPHA,6-BETA,7-BETA]-HEXAHYDRO-5,6-DI(HYDROXY)-1,3-DI(ALLYL)-4,7-BISPHENYLMETHYL)-2H-1,3-DIAZEPINONE | |||
1hxb | [A2] | [A2] | [A2] | 2.3 | ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
1hxw | [A2] | [A2] | [A2] | 1.8 | RIT:RITONAVIR | |||
1ibq | [A] | [A] | [A] | 2.14 | MAN:ALPHA-D-MANNOPYRANOSE ZN:ZINC ION | |||
1ida | [A2] | [A2] | [A2] | 1.7 | 0PO:N-[(1R)-1-{[(1S,2S)-1-BENZYL-3-{(2R,4S)-2-(TERT-BUTYLCARBAMOYL)-4-[(PYRIDIN-3-YLMETHYL)SULFANYL]PIPERIDIN-1-YL}-2-HYDROXYPROPYL]CARBAMOYL}-2-METHYLPROPYL]QUINOLINE-2-CARBOXAMIDE | |||
1idb | [A2] | [A2] | [A2] | 2.2 | 0DO:(2R,4S)-N-TERT-BUTYL-1-[(2S,3S)-3-{[(2,6-DIMETHYLPHENOXY)ACETYL]AMINO}-2-HYDROXY-4-PHENYLBUTYL]-4-(PYRIDIN-4-YLSULFONYL)PIPERIDINE-2-CARBOXAMIDE | |||
1iiq | [A2] | [A2] | [A2] | 1.83 | 0ZR:N-{(2R,3S)-3-[(TERT-BUTOXYCARBONYL)AMINO]-2-HYDROXY-4-PHENYLBUTYL}-L-PHENYLALANYL-L-GLUTAMINYL-L-PHENYLALANINAMIDE GOL:GLYCEROL | |||
1ivp | [A2] | [A2] | [A2] | 2.5 | 1ZK:4-[(2R)-3-{[(1S,2S,3R,4S)-1-(CYCLOHEXYLMETHYL)-2,3-DIHYDROXY-5-METHYL-4-({(1S,2R)-2-METHYL-1-[(PYRIDIN-2-YLMETHYL)CARBAMOYL]BUTYL}CARBAMOYL)HEXYL]AMINO}-2-{[(NAPHTHALEN-1-YLOXY)ACETYL]AMINO}-3-OXOPROPYL]-1H-IMIDAZOL-3-IUM | |||
1ivq | [A2] | [A2] | [A2] | 2.6 | 0PX:N~1~-{(1S,2S,4S)-1-(CYCLOHEXYLMETHYL)-4-[(2,2-DIMETHYLPROPYL)CARBAMOYL]-2-HYDROXY-5-METHYLHEXYL}-N~2~-(QUINOLIN-2-YLCARBONYL)-L-ASPARTAMIDE | |||
1izd | [A] | [A] | [A] | 1.9 | MAN:ALPHA-D-MANNOPYRANOSE | |||
1ize | [A][a] | [A][a] | [A][a] | 1.9 | IVA:ISOVALERIC ACID MAN:ALPHA-D-MANNOPYRANOSE STA:STATINE | |||
1izh | [A2] | [A2] | [A2] | 1.9 | Q50:{(1S)-1-BENZYL-4-[3-CARBAMOYL-1-(1-CARBAMOYL-2-PHENYL-ETHYLCARBAMOYL)-(S)-PROPYLCARBAMOYL]-2-OXO-5-PHENYL-PENTYL}-CARBAMIC ACID TERT-BUTYL ESTER | |||
1izi | [A2] | [A2] | [A2] | 2.15 | CL:CHLORIDE ION Q50:{(1S)-1-BENZYL-4-[3-CARBAMOYL-1-(1-CARBAMOYL-2-PHENYL-ETHYLCARBAMOYL)-(S)-PROPYLCARBAMOYL]-2-OXO-5-PHENYL-PENTYL}-CARBAMIC ACID TERT-BUTYL ESTER | |||
1j71 | [A][a] | [A][a] | [A][a] | 1.8 | EOH:ETHANOL | |||
1jld | [A2] | [A2] | [A2] | 2.5 | 0PP:(2S)-2-TERT-BUTYL-N~4~-(1-ETHYLPROPYL)-N~1~-[(2R,3S)-2-HYDROXY-4-PHENYL-3-{[N-(QUINOLIN-2-YLCARBONYL)-L-THREONYL]AMINO}BUTYL]BUTANEDIAMIDE | |||
1k1t | [A2] | [A2] | [A2] | 1.2 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE SO4:SULFATE ION | |||
1k1u | [A2] | [A2] | [A2] | 1.55 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE | |||
1k2b | [A2] | [A2] | [A2] | 1.7 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE | |||
1k2c | [A2] | [A2] | [A2] | 2.2 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE | |||
1k6c | [A2] | [A2] | [A2] | 2.2 | ACT:ACETATE ION MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE | |||
1k6p | [A2] | [A2] | [A2] | 2.2 | ACT:ACETATE ION XN3:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(BENZO[1,3]DIOXOL-5-YLMETHYL)-PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE | |||
1k6t | [A2] | [A2] | [A2] | 2.25 | ACT:ACETATE ION XN1:N-[2-HYDROXY-1-INDANYL]-5-[(2-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4-HYDROXY-2-(1-PHENYLETHYL)-PEN TANAMIDE | |||
1k6v | [A2] | [A2] | [A2] | 2 | ACT:ACETATE ION XN2:N-[2-HYDROXY-1-INDANYL]-5-[(2-TERTIARYBUTYLAMINOCARBONYL)-4(BENZO[1,3]DIOXOL-5-YLMETHYL)-PIPERAZINO]-4-HYDROXY-2-(1-PHE NYLETHYL)-PENTANAMIDE | |||
1kj4 | [A2][a] | [A2][a] | [A2][a] | 2.9 | ACT:ACETATE ION | |||
1kj7 | [A2][a] | [A2][a] | [A2][a] | 2 | ACT:ACETATE ION | |||
1kjf | [A2][a] | [A2][a] | [A2][a] | 2 | ACT:ACETATE ION | |||
1kjg | [A2][a] | [A2][a] | [A2][a] | 2 | ACT:ACETATE ION | |||
1kjh | [A2][a] | [A2][a] | [A2][a] | 2 | ACT:ACETATE ION | |||
1kzk | [A2] | [A2] | [A2] | 1.09 | CL:CHLORIDE ION EDO:1,2-ETHANEDIOL JE2:(4R)-3-{(2S,3S)-2-HYDROXY-3-[(3-HYDROXY-2-METHYLBENZOYL)AMINO]-4-PHENYLBUTANOYL}-5,5-DIMETHYL-N-(2-METHYLBENZYL)-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
1lee | [A] | [A] | [A] | 1.9 | R36:4-AMINO-N-{4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-1-ISOBUTYL-5-PHENYL-PENTYL}-BENZAMIDE | |||
1lf2 | [A] | [A] | [A] | 1.8 | R37:3-AMINO-N-{4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-1-ISOBUTYL-5-PHENYL-PENTYL}-BENZAMIDE | |||
1lf3 | [A] | [A] | [A] | 2.7 | EH5:N-(1-BENZYL-3-{[3-(1,3-DIOXO-1,3-DIHYDRO-ISOINDOL-2-YL)-PROPIONYL]-[2-(HEXAHYDRO-BENZO[1,3]DIOXOL-5-YL)-ETHYL]-AMINO}-2-HYDROXY-PROPYL)-4-BENZYLOXY-3,5-DIMETHOXY-BENZAMIDE | |||
1lf4 | [A] | [A] | [A] | 1.9 | ||||
1ls5 | [A][a] | [A][a] | [A][a] | 2.8 | IVA:ISOVALERIC ACID STA:STATINE | |||
1lv1 | [A] | [A] | [A] | 2.1 | ||||
1lya | [A2B2] | [A2B2] | [A4] | 2.5 | BMA:BETA-D-MANNOPYRANOSE MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
1lyb | [A2B2][a2] | [A2B2][a2] | [A4][a2] | 2.5 | BMA:BETA-D-MANNOPYRANOSE IVA:ISOVALERIC ACID MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE STA:STATINE | |||
1lyw | [AB] | [AB] | [A2] | 2.5 | EPE:4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID | |||
1lzq | [A2] | [A2] | [A2] | 2.2 | 0ZQ:N-{(3S)-3-[(TERT-BUTOXYCARBONYL)AMINO]-4-PHENYLBUTYL}-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-PHENYLALANINAMIDE BME:BETA-MERCAPTOETHANOL | |||
1m0b | [A2] | [A2] | [A2] | 2.45 | 0ZQ:N-{(3S)-3-[(TERT-BUTOXYCARBONYL)AMINO]-4-PHENYLBUTYL}-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-PHENYLALANINAMIDE GOL:GLYCEROL | |||
1m43 | [A][a] | [A][a] | [A][a] | 2.4 | IVA:ISOVALERIC ACID STA:STATINE | |||
1m4h | [A][a] | [A][a] | [A][a] | 2.1 | 1OL:(2R,4S,5S)-5-AMINO-4-HYDROXY-2,7-DIMETHYLOCTANOIC ACID | |||
1me6 | [A] | [A] | [A] | 2.7 | IVS:3-HYDROXY-6-METHYL-4-(3-METHYL-2-(3-METHYL-2-(3-METHYL-BUTYRYLAMINO)-BUTYRYLAMINO)-BUTYRYLAMINO)-HEPTANOICACID ETHYL ESTER | |||
1mer | [A2] | [A2] | [A2] | 1.9 | DMQ:[4-R-(-4-ALPHA,5-ALPHA,6-BETA,7-BETA)]-HEXAHYDRO-5,6-BIS(HYDROXY)-1,3-BIS([(3-AMINO)PHENYL]METHYL)-4,7-BIS(PHENYLMETHYL)-2H-1,3-DIAZEPINONE | |||
1mes | [A2] | [A2] | [A2] | 1.9 | DMP:[4-R-(-4-ALPHA,5-ALPHA,6-BETA,7-BETA)]-HEXAHYDRO-5,6-BIS(HYDROXY)-[1,3-BIS([4-HYDROXYMETHYL-PHENYL]METHYL)-4,7-BIS(PHEN YLMETHYL)]-2H-1,3-DIAZEPINONE | |||
1met | [A2] | [A2] | [A2] | 1.9 | DMP:[4-R-(-4-ALPHA,5-ALPHA,6-BETA,7-BETA)]-HEXAHYDRO-5,6-BIS(HYDROXY)-[1,3-BIS([4-HYDROXYMETHYL-PHENYL]METHYL)-4,7-BIS(PHEN YLMETHYL)]-2H-1,3-DIAZEPINONE | |||
1meu | [A2] | [A2] | [A2] | 1.9 | DMP:[4-R-(-4-ALPHA,5-ALPHA,6-BETA,7-BETA)]-HEXAHYDRO-5,6-BIS(HYDROXY)-[1,3-BIS([4-HYDROXYMETHYL-PHENYL]METHYL)-4,7-BIS(PHEN YLMETHYL)]-2H-1,3-DIAZEPINONE | |||
1miq | [A] | [A] | [A] | 2.5 | ||||
1mpp | [A] | [A] | [A] | 2 | SO4:SULFATE ION | |||
1mrw | [A2] | [A2] | [A2] | 2 | K57:(4R)-N-TERT-BUTYL-3-{(2S,3S)-2-HYDROXY-3-[(3-HYDROXY-2-METHYLBENZOYL)AMINO]-4-PHENYLBUTANOYL}-5,5-DIMETHYL-1,3-THIAZOLI DINE-4-CARBOXAMIDE | |||
1mrx | [A2] | [A2] | [A2] | 2 | K57:(4R)-N-TERT-BUTYL-3-{(2S,3S)-2-HYDROXY-3-[(3-HYDROXY-2-METHYLBENZOYL)AMINO]-4-PHENYLBUTANOYL}-5,5-DIMETHYL-1,3-THIAZOLI DINE-4-CARBOXAMIDE | |||
1msm | [A2] | [A2] | [A2] | 2 | JE2:(4R)-3-{(2S,3S)-2-HYDROXY-3-[(3-HYDROXY-2-METHYLBENZOYL)AMINO]-4-PHENYLBUTANOYL}-5,5-DIMETHYL-N-(2-METHYLBENZYL)-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
1msn | [A2] | [A2] | [A2] | 2 | JE2:(4R)-3-{(2S,3S)-2-HYDROXY-3-[(3-HYDROXY-2-METHYLBENZOYL)AMINO]-4-PHENYLBUTANOYL}-5,5-DIMETHYL-N-(2-METHYLBENZYL)-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
1mt7 | [A2][a] | [A2][a] | [A2][a] | 1.9 | ACT:ACETATE ION | |||
1mt8 | [A2][a] | [A2][a] | [A2][a] | 2.15 | ACT:ACETATE ION | |||
1mt9 | [A2][a] | [A2][a] | [A2][a] | 2 | PO4:PHOSPHATE ION | |||
1mtb | [A2] | [A2] | [A2] | 2.5 | ASN:ASPARAGINE DIQ:2-METHYL-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID HPH:(2S)-2-AMINO-3-PHENYLPROPANE-1,1-DIOL NTB:TERTIARY-BUTYLAMINE QNC:QUINOLINE-2-CARBOXYLIC ACID | |||
1mtr | [A2] | [A2] | [A2] | 1.75 | ABA:ALPHA-AMINOBUTYRIC ACID PI6:[1-BENZYL-3-(8-SEC-BUTYL-7,10-DIOXO-2-OXA-6,9-DIAZA-BICYCLO[11.2.2] HEPTADECA-1(16),13(17),14-TRIEN-11-YLAMINO)-2-HYDROXY-PROPYL]-CARBAMIC ACID TERT-BUTYLESTER SO4:SULFATE ION | |||
1mui | [A2] | [A2] | [A2] | 2.8 | AB1:N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE | |||
1mvp | [A2] | [A2] | [A2] | 2.2 | ||||
1n49 | [A2] | [A2] | [A2] | 2.2 | RIT:RITONAVIR | |||
1nh0 | [A2][a2] | [A2][a2] | [A2][a2] | 1.03 | BME:BETA-MERCAPTOETHANOL KI2:3-BENZYLOXYCARBONYLAMINO-2-HYDROXY-4-PHENYL-BUTYRICACID NH2:AMINO GROUP SO4:SULFATE ION | |||
1npa | [A2] | [A2] | [A2] | 2 | 3NH:(3S)-TETRAHYDROFURAN-3-YL (1R,2S)-3-[4-((1R)-2-{[(S)-AMINO(HYDROXY)METHYL]OXY}-2,3-DIHYDRO-1H-INDEN-1-YL)-2-BENZYL-3-OXOPYRROLIDIN-2-YL]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
1npv | [A2] | [A2] | [A2] | 2 | L27:{1-BENZYL-3-[2-BENZYL-3-OXO-4-(1-OXO-1,2,3,4-TETRAHYDRO- ISOQUINOLIN-4-YL)-2,3-DIHYDRO-1H-PYRROL-2-YL]-2- HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YL ESTER | |||
1npw | [A2] | [A2] | [A2] | 2 | LGZ:CARBAMIC ACID 1-{5-BENZYL-5-[2-HYDROXY-4-PHENYL-3-(TETRAHYDRO-FURAN- 3-YLOXYCARBONYLAMINO)-BUTYL]-4-OXO-4,5-DIHYDRO-1H-PYRROL-3-YL}- INDAN-2-YL ESTER | |||
1nso | [A] | [A] | [A] | NOTAPPLICABLE. | ||||
1od1 | [A] | [A] | [A] | 1.37 | 0QS:N~2~-[(2R)-2-BENZYL-3-(TERT-BUTYLSULFONYL)PROPANOYL]-N-{(1R)-1-(CYCLOHEXYLMETHYL)-3,3-DIFLUORO-2,2-DIHYDROXY-4-[(2-MORPHOLIN-4-YLETHYL)AMINO]-4-OXOBUTYL}-3-(1H-IMIDAZOL-3-IUM-4-YL)-L-ALANINAMIDE SO4:SULFATE ION | |||
1odw | [A2] | [A2] | [A2] | 2.1 | 0E8:DI-TERT-BUTYL {IMINOBIS[(2S,3S)-3-HYDROXY-1-PHENYLBUTANE-4,2-DIYL]}BISCARBAMATE | |||
1odx | [A2] | [A2] | [A2] | 2 | 0E8:DI-TERT-BUTYL {IMINOBIS[(2S,3S)-3-HYDROXY-1-PHENYLBUTANE-4,2-DIYL]}BISCARBAMATE | |||
1ody | [A2] | [A2] | [A2] | 2 | LP1:4-[2-(2-ACETYLAMINO-3-NAPHTALEN-1-YL-PROPIONYLAMINO)-4-METHYL-PENTANOYLAMINO]-3-HYDROXY-6-METHYL-HEPTANOICACID [1-(1-CARBAMOYL-2-NAPHTHALEN-1-YL-ETHYLCARBAMOYL)-PROPYL]-AMIDE | |||
1oew | [A] | [A] | [A] | 0.9 | GOL:GLYCEROL SER:SERINE SO4:SULFATE ION SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID THR:THREONINE | |||
1oex | [A][a] | [A][a] | [A][a] | 1.1 | BOC:TERT-BUTYL HYDROGEN CARBONATE GOL:GLYCEROL LOV:5-AMINO-4-HYDROXY-2-ISOPROPYL-7-METHYL-OCTANOIC ACID SO4:SULFATE ION SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
1ohr | [A2] | [A2] | [A2] | 2.1 | 1UN:2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL SULFANYL-BUTYL]-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID TERT-BUTYLAMIDE | |||
1pfz | [A] | [A] | [A] | 1.85 | GOL:GLYCEROL | |||
1ppk | [A] | [A] | [A] | 1.8 | DMF:DIMETHYLFORMAMIDE HSY:ALPHA-L-XYLOPYRANOSE IVV:N-(3-METHYLBUTANOYL)-L-VALYL-N-{(1R)-1-[(R)-(2-ETHOXY-2-OXOETHYL)(HYDROXY)PHOSPHORYL]-3-METHYLBUTYL}-L-VALINAMIDE MAN:ALPHA-D-MANNOPYRANOSE SO4:SULFATE ION | |||
1ppl | [A] | [A] | [A] | 1.7 | 1Z7:N-(3-METHYLBUTANOYL)-L-VALYL-N-{(1S)-1-[(R)-[(1R)-1-BENZYL-2-METHOXY-2-OXOETHOXY](HYDROXY)PHOSPHORYL]-3-METHYLBUTYL}-L- VALINAMIDE MAN:ALPHA-D-MANNOPYRANOSE SO4:SULFATE ION XYS:ALPHA-D-XYLOPYRANOSE | |||
1ppm | [A] | [A] | [A] | 1.7 | 0P1:N-[(BENZYLOXY)CARBONYL]-L-ALANYL-N-{(1S)-1-[(R)-[(1R)-1-BENZYL-2-METHOXY-2-OXOETHOXY](HYDROXY)PHOSPHORYL]-3-METHYLBUTYL }-L-ALANINAMIDE ARA:ALPHA-L-ARABINOPYRANOSE MAN:ALPHA-D-MANNOPYRANOSE SO4:SULFATE ION | |||
1pro | [A2] | [A2] | [A2] | 1.8 | A88:(5R,6R)-2,4-BIS-(4-HYDROXY-3-METHOXYBENZYL)-1,5-DIBENZYL-3-OXO-6-HYDROXY-1,2,4-TRIAZACYCLOHEPTANE | |||
1psa | [A2] | [A2] | [A2] | 2.9 | 0ZL:N-(ETHOXYCARBONYL)-L-LEUCYL-N-[(1R,2S,3S)-1-(CYCLOHEXYLMETHYL)-2,3-DIHYDROXY-5-METHYLHEXYL]-L-LEUCINAMIDE | |||
1psn | [A] | [A] | [A] | 2.2 | ||||
1pso | [A][a] | [A][a] | [A][a] | 2 | IVA:ISOVALERIC ACID STA:STATINE | |||
1q9p | [A] | [A] | [A] | NOTAPPLICABLE. | ||||
1qbr | [A2] | [A2] | [A2] | 1.8 | XV6:[4R-(4ALPHA,5ALPHA,6BETA,7BETA)]-3,3___sq___-[[TETRAHYDRO-5,6-DIHYDROXY-2-OXO-4,7-BIS(PHENYLMETHYL)-1H-1,3-DIAZEPINE-1,3(2H)-DIYL] BIS(METHYLENE)]BIS[N-2-THIAZOLYLBENZAMIDE] | |||
1qbs | [A2] | [A2] | [A2] | 1.8 | CSO:S-HYDROXYCYSTEINE DMP:[4-R-(-4-ALPHA,5-ALPHA,6-BETA,7-BETA)]-HEXAHYDRO-5,6-BIS(HYDROXY)-[1,3-BIS([4-HYDROXYMETHYL-PHENYL]METHYL)-4,7-BIS(PHENYLMETHYL)]-2H-1,3-DIAZEPINONE | |||
1qbt | [A2] | [A2] | [A2] | 2.1 | 146:[4R-(4ALPHA,5ALPHA,6ALPHA,7ALPHA)]-3,3___sq___-{{TETRAHYDRO-5,6-DIHYDROXY-2-OXO-4,7-BIS(PHENYLMETHYL)-1H-1,3-DIAZEPINE-1,3(2H)-DIYL]BIS(METHYLENE)]BIS[N-1H-BENZIMIDAZOL-2-YLBENZAMIDE] | |||
1qbu | [A2] | [A2] | [A2] | 1.8 | 846:[4R--(1ALPHA,5ALPHA,7BETA)]-3-[(CYCLOPROPHYLMETHYL)HEXAHYDRO-5,6-DIHYDROXY-2-OXO-4,7-BIS(PHENYLMETHYL)-1H-1,3-DIAZEPIN]METHYL-2-THIAZOLYLBENZAMIDE | |||
1qdm | [A] | [A] | [A] | 2.3 | ||||
1qrp | [A] | [A] | [A] | 1.96 | HH0:METHYL N-[(2S)-2-({(S)-HYDROXY[(1R)-3-METHYL-1-{[N-(3-METHYLBUTANOYL)-L-VALYL-L-VALYL]AMINO}BUTYL]PHOSPHORYL}OXY)-3-PHENYLPROPANOYL]-L-ALANYL-L-ALANINATE | |||
1qs8 | [A][a] | [A][a] | [A][a] | 2.5 | ACT:ACETATE ION IVA:ISOVALERIC ACID STA:STATINE | |||
1rl8 | [A2] | [A2] | [A2] | 2 | RIT:RITONAVIR | |||
1rne | [A2] | [A2] | [A2] | 2.4 | C60:[[[3-(2-METHYL-PROPANE-2-SULFONYL)-1-BENZENYL]-2-PROPYL]-CARBONYL-HISTIDYL]-AMINO-[CYCLOHEXYLMETHYL]-[2-HYDROXY-4-ISOPROPYL]-PENTAN-5-OIC ACID BUTYLAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
1rpi | [A2] | [A2] | [A2] | 1.86 | GLC:ALPHA-D-GLUCOPYRANOSE | |||
1rq9 | [A2] | [A2] | [A2] | 2.6 | DMQ:[4-R-(-4-ALPHA,5-ALPHA,6-BETA,7-BETA)]-HEXAHYDRO-5,6-BIS(HYDROXY)-1,3-BIS([(3-AMINO)PHENYL]METHYL)-4,7-BIS(PHENYLMETHYL)-2H-1,3-DIAZEPINONE | |||
1rv7 | [A2] | [A2] | [A2] | 2.7 | AB1:N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE | |||
1sbg | [A2] | [A2] | [A2] | 2.3 | IM1:(2R,4S,5S,1___sq___S)-2-PHENYLMETHYL-4-HYDROXY-5-(TERT-BUTOXYCARBONYL)AMINO-6-PHENYL HEXANOYL-N-(1___sq___-IMIDAZO-2-YL)-2___sq___-METHYLPROPANAMIDE | |||
1sdt | [A2] | [A2] | [A2] | 1.3 | CL:CHLORIDE ION MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE | |||
1sdu | [A2] | [A2] | [A2] | 1.25 | ACT:ACETATE ION MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE SO4:SULFATE ION | |||
1sdv | [A2] | [A2] | [A2] | 1.4 | CL:CHLORIDE ION MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE | |||
1sgu | [A2] | [A2] | [A2] | 1.9 | MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE | |||
1sgz | [A] | [A] | [A] | 2 | ||||
1sh9 | [A2] | [A2] | [A2] | 2.5 | RIT:RITONAVIR | |||
1sip | [A2] | [A2] | [A2] | 2.3 | ||||
1siv | [A2] | [A2] | [A2] | 2.5 | PSI:METHYL N-{(4S,5S)-5-[(L-ALANYL-L-ALANYL)AMINO]-4-HYDROXY-6-PHENYLHEXANOYL}-L-VALYL-L-VALINATE | |||
1sme | [A][a] | [A][a] | [A][a] | 2.7 | IVA:ISOVALERIC ACID STA:STATINE | |||
1smr | [A][a] | [A][a] | [A][a] | 2 | LPL:LEU-HYDROXYETHYLENE-LEU PIV:PIVALIC ACID | |||
1sp5 | [A2][a] | [A2][a] | [A2][a] | 1.8 | BME:BETA-MERCAPTOETHANOL CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE | |||
1t3r | [A2] | [A2] | [A2] | 1.2 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE PO4:PHOSPHATE ION | |||
1t6e | [A] | [A] | [A] | 1.7 | GOL:GLYCEROL | |||
1t6g | [AB] | [AB] | [AB] | 1.8 | GOL:GLYCEROL | |||
1t7i | [A2] | [A2] | [A2] | 1.35 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION PO4:PHOSPHATE ION | |||
1t7j | [A2] | [A2] | [A2] | 2.2 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER ACT:ACETATE ION | |||
1t7k | [A2] | [A2] | [A2] | 2.1 | BH0:3-({5-BENZYL-6-HYDROXY-2,4-BIS-(4-HYDROXY-BENZYL)-3-OXO-[1,2,4]-TRIAZEPANE-1-SULFONYL)-BENZONITRILE | |||
1tcw | [A2] | [A2] | [A2] | 2.4 | IM1:(2R,4S,5S,1___sq___S)-2-PHENYLMETHYL-4-HYDROXY-5-(TERT-BUTOXYCARBONYL)AMINO-6-PHENYL HEXANOYL-N-(1___sq___-IMIDAZO-2-YL)-2___sq___-METHYLPROPANAMIDE | |||
1tcx | [A2] | [A2] | [A2] | 2.3 | IM1:(2R,4S,5S,1___sq___S)-2-PHENYLMETHYL-4-HYDROXY-5-(TERT-BUTOXYCARBONYL)AMINO-6-PHENYL HEXANOYL-N-(1___sq___-IMIDAZO-2-YL)-2___sq___-METHYLPROPANAMIDE | |||
1tqf | [A] | [A] | [A] | 1.8 | 32P:3-{2-[(5-AMINOPENTYL)AMINO]-2-OXOETHOXY}-5-({[1-(4-FLUOROPHENYL)ETHYL]AMINO}CARBONYL)PHENYLPHENYLMETHANESULFONATE | |||
1tsq | [A2][a] | [A2][a] | [A2][a] | 2 | ACT:ACETATE ION | |||
1tsu | [A2][a] | [A2][a] | [A2][a] | 2.1 | ||||
1tw7 | [A2] | [A2] | [A2] | 1.3 | NA:SODIUM ION | |||
1tzs | [A2B2][a2] | [A2B2][a2] | [A2B2][a2] | 2.35 | ||||
1u8g | [A2][a] | [A2][a] | [A2][a] | 2.2 | KI2:3-BENZYLOXYCARBONYLAMINO-2-HYDROXY-4-PHENYL-BUTYRICACID NH2:AMINO GROUP | |||
1uh7 | [A] | [A] | [A] | 2.1 | ||||
1uh8 | [A] | [A] | [A] | 2.3 | ||||
1uh9 | [A] | [A] | [A] | 2 | ||||
1upj | [A2] | [A2] | [A2] | 2.22 | U01:3-[1-(4-BROMO-PHENYL)-2-METHYL-PROPYL]-4-HYDROXY-CHROMEN-2-ONE | |||
1vij | [A2] | [A2] | [A2] | 2.4 | BAY:N-(1-BENZYL-2,3-DIHYDROXY-4-{3-METHYL-2-[2-(2-METHYL-PROPANE-2-SULFONYLMETHYL)-3-NAPHTHALEN-1-YL-PROPIONYLAMINO]-BUTYRYLAMINO}-5-PHENYL-PENTYL)-3-METHYL-2-[2-(2-METHYL-PROPANE-2-SULFONYLMETHYL)-3-NAPHTHALEN-1-YL-PROPIONYLAMINO]-BUTYRAMIDE | |||
1vik | [A2] | [A2] | [A2] | 2.4 | BAY:N-(1-BENZYL-2,3-DIHYDROXY-4-{3-METHYL-2-[2-(2-METHYL-PROPANE-2-SULFONYLMETHYL)-3-NAPHTHALEN-1-YL-PROPIONYLAMINO]-BUTYRYLAMINO}-5-PHENYL-PENTYL)-3-METHYL-2-[2-(2-METHYL-PROPANE-2-SULFONYLMETHYL)-3-NAPHTHALEN-1-YL-PROPIONYLAMINO]-BUTYRAMIDE | |||
1w50 | [A] | [A] | [A] | 1.75 | IOD:IODIDE ION | |||
1w51 | [A] | [A] | [A] | 2.55 | IOD:IODIDE ION L01:3-[({(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}AMINO)(HYDROXY)METHYL]-N,N-DIPROPYLBENZAMIDE | |||
1w5v | [A2] | [A2] | [A2] | 1.8 | BE3:N,N-[2,5-O-DI-3-FLUORO-BENZYL-GLUCARYL]-DI-[1-AMINO-INDAN-2-OL] | |||
1w5w | [A2] | [A2] | [A2] | 1.8 | BE4:(2R,3R,4R,5R)-2,5-BIS[(2,4-DIFLUOROBENZYL)OXY]-3,4-DIHYDROXY-N,N___sq___-BIS[(1R,2S)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]HEXANEDIAMIDE | |||
1w5x | [A2] | [A2] | [A2] | 1.9 | BE5:(2R,3R,4R,5R)-2,5-BIS[(2,3-DIFLUOROBENZYL)OXY]-3,4-DIHYDROXY-N,N___sq___-BIS[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]HEXANEDIAMIDE | |||
1w5y | [A2] | [A2] | [A2] | 1.9 | BE6:(2R,3R,4R,5R)-2,5-BIS[(2,5-DIFLUOROBENZYL)OXY]-3,4-DIHYDROXY-N,N___sq___-BIS[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]HEXANEDIAMIDE | |||
1w6h | [A] | [A] | [A] | 2.24 | TIT:N-((3S,4S)-5-[(4-BROMOBENZYL)OXY]-3-HYDROXY-4-{[N-(PYRIDIN-2-YLCARBONYL)-L-VALYL]AMINO}PENTANOYL)-L-ALANYL-L-LEUCINAMIDE | |||
1w6i | [A][a] | [A][a] | [A][a] | 2.7 | IVA:ISOVALERIC ACID STA:STATINE | |||
1wbk | [A2] | [A2] | [A2] | 2 | 568:N,N-[2,5-O-DIBENZYL-GLUCARYL]-DI-[1-AMINO-INDAN-2-OL] | |||
1wbm | [A2] | [A2] | [A2] | 2 | BLL:(2R,3R,4R,5R)-3,4-DIHYDROXY-N,N___sq___-BIS[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-2,5-BIS(2-PHENYLETHYL)HEXANEDIAMIDE | |||
1wkr | [A][a] | [A][a] | [A][a] | 1.3 | IVA:ISOVALERIC ACID SO4:SULFATE ION STA:STATINE | |||
1xdh | [A2][a2] | [A2][a2] | [A2][a2] | 1.7 | IVA:ISOVALERIC ACID STA:STATINE | |||
1xe5 | [A2] | [A2] | [A2] | 2.4 | 5FE:5,5,5-TRIFLUORO-3-HYDROXY-4-[2-(5,5,5-TRIFLUORO-3-HYDROXY-4-{3-METHYL-2-[3-METHYL-2-(3-METHYL-BUTYRYLAMINO)-BUTYRYLAMINO]-BUTYRYLAMINO}-PENTANOYLAMINO)-PROPIONYLAMINO]-PENTANOIC ACID METHYLESTER | |||
1xe6 | [A2] | [A2] | [A2] | 2.8 | 5FP:5,5,5-TRIFLUORO-3-HYDROXY-4-[2-(5,5,5-TRIFLUORO-3-HYDROXY-4-{3-METHYL-2-[3-METHYL-2-(3-METHYL-BUTYRYLAMINO)-BUTYRYLAMINO]-BUTYRYLAMINO}-PENTANOYLAMINO)-PROPIONYLAMINO]-PENTANOIC ACID | |||
1xl2 | [A2] | [A2] | [A2] | 1.5 | 189:N-BENZYL-2-(2,6-DIMETHYLPHENOXY)-N-[((3R,4S)-4-{[ISOBUTYL(PHENYLSULFONYL)AMINO]METHYL}PYRROLIDIN-3-YL)METHYL]ACETAMIDE CL:CHLORIDE ION GOL:GLYCEROL | |||
1xl5 | [A2] | [A2] | [A2] | 1.73 | 190:N-{(1S)-1-(3-BROMOBENZYL)-4-[(4-BROMOPHENYL)SULFONYL]-6-METHYL-2-OXOHEPTYL}-2-(2,6-DIMETHYLPHENOXY)ACETAMIDE CL:CHLORIDE ION | |||
1xn2 | [A][a] | [A][a] | [A][a] | 1.9 | 1OL:(2R,4S,5S)-5-AMINO-4-HYDROXY-2,7-DIMETHYLOCTANOIC ACID | |||
1xn3 | [A] | [A] | [A] | 2 | STA:STATINE | |||
1xs7 | [A] | [A] | [A] | 2.8 | MMI:N-[(4S,5S,7R)-8-({(S)-1-[(BENZYLAMINO)OXOMETHYL]-2-METHYLPROPYL}AMINO)-5-HYDROXY-2,7-DIMETHYL-8-OXO-OCT-4-YL]-(4S,7S)-4-ISOPROPYL-2,5,9-TRIOXO-1-OXA-3,6,10-TRIAZACYCLOHEXADECANE-7-CARBOXAMIDE | |||
1yg9 | [A] | [A] | [A] | 1.3 | CSX:S-OXY CYSTEINE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE ZN:ZINC ION | |||
1ym2 | [A][a] | [A][a] | [A][a] | 2.05 | 24O:(1R,2R)-2-[(1S,2S)-2-AMINO-1-HYDROXY-4-METHYLPENTYL]-4-OXOCYCLOPENTANECARBOXYLIC ACID ACE:ACETYL GROUP LYT:BUTYLAMINE | |||
1ym4 | [A][a] | [A][a] | [A][a] | 2.25 | 24M:(1R,2R)-2-[(1S,2S)-2-AMINO-1-HYDROXY-4-METHYLPENTYL]CYCLOPENTANECARBOXYLIC ACID | |||
1yt9 | [A2] | [A2] | [A2] | 3 | OIS:(S)-N-((2S,3R)-3-HYDROXY-4-(4-((E)-(HYDROXYIMINO)METHYL)-N-ISOBUTYLPHENYLSULFONAMIDO)-1-PHENYLBUTAN-2-YL)-3-METHYL-2-(3-((2-METHYLTHIAZOL-4-YL)METHYL)-2-OXOIMIDAZOLIDIN-1-YL)BUTANAMIDE | |||
1ytg | [A2][a] | [A2][a] | [A2][a] | 2.3 | NH2:AMINO GROUP | |||
1yth | [A2][a] | [A2][a] | [A2][a] | 2.2 | ACE:ACETYL GROUP | |||
1yti | [A2][a2] | [A2][a2] | [A2][a2] | 2.2 | ||||
1ytj | [A2][a2] | [A2][a2] | [A2][a2] | 2.5 | NLE:NORLEUCINE PPN:PARA-NITROPHENYLALANINE | |||
1yx9 | [A] | [A] | [A] | 3 | DMS:DIMETHYL SULFOXIDE | |||
1z1h | [A2] | [A2] | [A2] | 1.85 | ABA:ALPHA-AMINOBUTYRIC ACID HBB:N-{(2R)-2-HYDROXY-2-[(8S,11S)-8-ISOPROPYL-6,9-DIOXO-2-OXA-7,10-DIAZABICYCLO[11.2.2]HEPTADECA-1(15),13,16-TRIEN-11-YL]ETHYL}-N-ISOPENTYLBENZENESULFONAMIDE SO4:SULFATE ION | |||
1z1r | [A2] | [A2] | [A2] | 1.85 | ABA:ALPHA-AMINOBUTYRIC ACID HBH:2-[(8S,11S)-11-{(1R)-1-HYDROXY-2-[ISOPENTYL(PHENYLSULFONYL)AMINO]ETHYL}-6,9-DIOXO-2-OXA-7,10-DIAZABICYCLO[11.2.2]HEPTADECA-1(15),13,16-TRIEN-8-YL]ACETAMIDE SO4:SULFATE ION | |||
1z8c | [A2] | [A2] | [A2] | 2.2 | 0ZS:N-{(2R,3S)-3-[(TERT-BUTOXYCARBONYL)AMINO]-2-HYDROXY-4-PHENYLBUTYL}-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-PHENYLALANINAMIDE CME:S,S-(2-HYDROXYETHYL)THIOCYSTEINE SO4:SULFATE ION | |||
1zap | [A] | [A] | [A] | 2.5 | A70:N-ETHYL-N-[(4-METHYLPIPERAZIN-1-YL)CARBONYL]-D-PHENYLALANYL-N-[(1S,2S,4R)-4-(BUTYLCARBAMOYL)-1-(CYCLOHEXYLMETHYL)-2-HYDROXY-5-METHYLHEXYL]-L-NORLEUCINAMIDE ZN:ZINC ION | |||
1zbg | [A2] | [A2] | [A2] | 2 | 0ZS:N-{(2R,3S)-3-[(TERT-BUTOXYCARBONYL)AMINO]-2-HYDROXY-4-PHENYLBUTYL}-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-PHENYLALANINAMIDE CL:CHLORIDE ION CME:S,S-(2-HYDROXYETHYL)THIOCYSTEINE NA:SODIUM ION | |||
1zj7 | [A2] | [A2] | [A2] | 1.93 | 0ZT:N-{(2S,3S)-3-[(TERT-BUTOXYCARBONYL)AMINO]-2-HYDROXY-4-PHENYLBUTYL}-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-PHENYLALANINAMIDE | |||
1zlf | [A2] | [A2] | [A2] | 2.3 | 0ZR:N-{(2R,3S)-3-[(TERT-BUTOXYCARBONYL)AMINO]-2-HYDROXY-4-PHENYLBUTYL}-L-PHENYLALANYL-L-GLUTAMINYL-L-PHENYLALANINAMIDE | |||
1zp8 | [A2] | [A2] | [A2] | 2.02 | AB2:[1-((1S,2R)-1-BENZYL-2-HYDROXY-3-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}PROPYL)-1H-1,2,3-TRIAZOL-4-YL]METHYL (1R,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YLCARBAMATE | |||
1zpa | [A2] | [A2] | [A2] | 2.02 | A83:TERT-BUTYL 4-[({[1-((1S,2R)-1-BENZYL-2-HYDROXY-3-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}PROPYL)-1H-1,2,3-TRIAZOL-4-YL]METHYL}AMINO)CARBONYL]BENZYLCARBAMATE | |||
1zpk | [A2] | [A2] | [A2] | 1.65 | 0ZS:N-{(2R,3S)-3-[(TERT-BUTOXYCARBONYL)AMINO]-2-HYDROXY-4-PHENYLBUTYL}-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-PHENYLALANINAMIDE CL:CHLORIDE ION CME:S,S-(2-HYDROXYETHYL)THIOCYSTEINE NA:SODIUM ION | |||
1zsf | [A2] | [A2] | [A2] | 1.98 | 0ZS:N-{(2R,3S)-3-[(TERT-BUTOXYCARBONYL)AMINO]-2-HYDROXY-4-PHENYLBUTYL}-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-PHENYLALANINAMIDE CSO:S-HYDROXYCYSTEINE | |||
1zsr | [A2] | [A2] | [A2] | 2.06 | 0ZT:N-{(2S,3S)-3-[(TERT-BUTOXYCARBONYL)AMINO]-2-HYDROXY-4-PHENYLBUTYL}-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-PHENYLALANINAMIDE CSO:S-HYDROXYCYSTEINE | |||
1ztz | [A2][a] | [A2][a] | [A2][a] | 2.15 | CB5:COBALT BIS(1,2-DICARBOLLIDE) | |||
2a1e | [A2] | [A2] | [A2] | 1.3 | ACT:ACETATE ION CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL IPF:N-ACETYLTRYPTOPHYL-N~1~-{3-[1-(N-ACETYLTRYPTOPHYLVALYL)PYRROLIDIN-2-YL]-1-BENZYL-2,3-DIHYDROXYPROPYL}VALINAMIDE NA:SODIUM ION | |||
2a4f | [A2] | [A2] | [A2] | 1.9 | AAU:(5R,6R)-5-BENZYL-6-HYDROXY-2,4-BIS(4-HYDROXY-3-METHOXYBENZYL)-1-[3-(4-HYDROXYPHENYL)PROPANOYL]-1,2,4-TRIAZEPAN-3-ONE | |||
2aid | [A2] | [A2] | [A2] | 1.9 | CL:CHLORIDE ION THK:4-(4-CHLORO-PHENYL)-1-{3-[2-(4-FLUORO-PHENYL)-[1,3]DITHIOLAN-2-YL]-PROPYL}-PIPERIDIN-4-OL | |||
2anl | [A] | [A] | [A] | 3.3 | JE2:(4R)-3-{(2S,3S)-2-HYDROXY-3-[(3-HYDROXY-2-METHYLBENZOYL)AMINO]-4-PHENYLBUTANOYL}-5,5-DIMETHYL-N-(2-METHYLBENZYL)-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
2aoc | [A2] | [A2] | [A2] | 1.3 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL NA:SODIUM ION UNX:UNKNOWN ATOM OR ION | |||
2aod | [A2] | [A2] | [A2] | 1.4 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL UNX:UNKNOWN ATOM OR ION | |||
2aoe | [A2] | [A2] | [A2] | 1.54 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE ACY:ACETIC ACID CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL NA:SODIUM ION | |||
2aof | [A2][a] | [A2][a] | [A2][a] | 1.32 | ACY:ACETIC ACID CL:CHLORIDE ION FRD:1-PHENYL-2-AMINOPROPANE NA:SODIUM ION NH2:AMINO GROUP | |||
2aog | [A2] | [A2] | [A2] | 1.1 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ACY:ACETIC ACID GOL:GLYCEROL UNX:UNKNOWN ATOM OR ION | |||
2aoh | [A2][a] | [A2][a] | [A2][a] | 1.42 | CL:CHLORIDE ION FRD:1-PHENYL-2-AMINOPROPANE NA:SODIUM ION | |||
2aoi | [A2][a] | [A2][a] | [A2][a] | 1.4 | FRD:1-PHENYL-2-AMINOPROPANE NH2:AMINO GROUP SO4:SULFATE ION | |||
2aoj | [A2][a] | [A2][a] | [A2][a] | 1.6 | ACY:ACETIC ACID DMS:DIMETHYL SULFOXIDE FRD:1-PHENYL-2-AMINOPROPANE GOL:GLYCEROL NH2:AMINO GROUP | |||
2apr | [A] | [A] | [A] | 1.8 | CA:CALCIUM ION | |||
2aqu | [A2] | [A2] | [A2] | 2 | DR7:(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5,6,10,13-PENTAAZATETRADECANEDIOICACID DIMETHYL ESTER | |||
2asi | [A] | [A] | [A] | 2.15 | BMA:BETA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
2avm | [A2] | [A2] | [A2] | 1.1 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ACY:ACETIC ACID GOL:GLYCEROL | |||
2avo | [A2] | [A2] | [A2] | 1.1 | ACY:ACETIC ACID DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE SO4:SULFATE ION | |||
2avq | [A2] | [A2] | [A2] | 1.3 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
2avs | [A2] | [A2] | [A2] | 1.1 | ACY:ACETIC ACID DMS:DIMETHYL SULFOXIDE MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE PO4:PHOSPHATE ION SO4:SULFATE ION | |||
2avv | [A2] | [A2] | [A2] | 1.5 | ACY:ACETIC ACID CL:CHLORIDE ION MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE | |||
2az8 | [A2] | [A2] | [A2] | 2 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE | |||
2az9 | [A2] | [A2] | [A2] | 2.5 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE | |||
2azb | [A2] | [A2] | [A2] | 2.03 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE | |||
2azc | [A2] | [A2] | [A2] | 2.01 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE | |||
2b42 | [AB] | [AB] | [AB] | 2.5 | ||||
2b60 | [A2] | [A2] | [A2] | 2.2 | GOL:GLYCEROL RIT:RITONAVIR | |||
2b7f | [A2][a] | [A2][a] | [A2][a] | 2.6 | ACE:ACETYL GROUP PO4:PHOSPHATE ION STA:STATINE | |||
2b7z | [A2] | [A2] | [A2] | 2.2 | MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE | |||
2b8l | [A] | [A] | [A] | 1.7 | 5HA:N-[(1S,2R)-1-BENZYL-3-(CYCLOPROPYLAMINO)-2-HYDROXYPROPYL]-5-[METHYL(METHYLSULFONYL)AMINO]-N___sq___-[(1R)-1-PHENYLETHYL]ISOPHTHALAMIDE | |||
2b8v | [A] | [A] | [A] | 1.8 | 3BN:3-BENZOYL-N-[(1S,2R)-1-BENZYL-3-(CYCLOPROPYLAMINO)-2-HYDROXYPROPYL]-5-[METHYL(METHYLSULFONYL)AMINO]BENZAMIDE | |||
2bb9 | [A2] | [A2] | [A2] | 1.35 | AKC:2-ETHOXYETHYL (1S,2S)-3-{(2S)-4-[(3AS,8S,8AR)-2-OXO-3,3A,8,8A-TETRAHYDRO-2H-INDENO[1,2-D][1,3]OXAZOL-8-YL]-2-BENZYL-3-OXO-2,3-DIHYDRO-1H-PYRROL-2-YL}-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
2bbb | [A2] | [A2] | [A2] | 1.7 | HH1:(3S)-TETRAHYDROFURAN-3-YL (1R)-3-{(2R)-4-[(1S,3S)-3-(2-AMINO-2-OXOETHYL)-2,3-DIHYDRO-1H-INDEN-1-YL]-2-BENZYL-3-OXO-2,3-DIHYDRO-1H-PYRROL-2-YL}-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
2bju | [A] | [A] | [A] | 1.56 | IH4:N-(R-CARBOXY-ETHYL)-ALPHA-(S)-(2-PHENYLETHYL) | |||
2bks | [A] | [A] | [A] | 2.2 | PZ1:(6R)-6-({[1-(3-HYDROXYPROPYL)-1,7-DIHYDROQUINOLIN-7-YL]OXY}METHYL)-1-(4-{3-[(2-METHOXYBENZYL)OXY]PROPOXY}PHENYL)PIPERAZIN-2-ONE | |||
2bkt | [A] | [A] | [A] | 2.3 | RPF:1-{4-[3-(2-METHOXY-BENZYLOXY)-PROPOXY]-PHENYL}-6-(1,2,,3,4-TETRAHYDRO-QUINOLIN-7-YLOXYMETHYL)-PIPERAZIN-2-ONE | |||
2bpv | [A2] | [A2] | [A2] | 1.9 | 1IN:1-[2-HYDROXY-4-(2-HYDROXY-5-METHYL-CYCLOPENTYLCARBAMOYL)5-PHENYL-PENTYL]-4-(3-PYRIDIN-3-YL-PROPIONYL)-PIPERAZINE-2-CARBOXYLIC ACID TERT-BUTYLAMIDE | |||
2bpw | [A2] | [A2] | [A2] | 2.8 | 1IN:1-[2-HYDROXY-4-(2-HYDROXY-5-METHYL-CYCLOPENTYLCARBAMOYL)5-PHENYL-PENTYL]-4-(3-PYRIDIN-3-YL-PROPIONYL)-PIPERAZINE-2-CARBOXYLIC ACID TERT-BUTYLAMIDE | |||
2bpx | [A2] | [A2] | [A2] | 2.8 | MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE | |||
2bpy | [A2] | [A2] | [A2] | 1.9 | 3IN:N-[2(S)-CYCLOPENTYL-1(R)-HYDROXY-3(R)METHYL]-5-[(2(S)-TERTIARY-BUTYLAMINO-CARBONYL)-4-(N1-(2)-(N-METHYLPIPERAZINYL)-3-CHLORO-PYRAZINYL-5-CARBONYL)-PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYL-PENTANAMIDE | |||
2bpz | [A2] | [A2] | [A2] | 2.5 | 3IN:N-[2(S)-CYCLOPENTYL-1(R)-HYDROXY-3(R)METHYL]-5-[(2(S)-TERTIARY-BUTYLAMINO-CARBONYL)-4-(N1-(2)-(N-METHYLPIPERAZINYL)-3-CHLORO-PYRAZINYL-5-CARBONYL)-PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYL-PENTANAMIDE | |||
2bqv | [A2] | [A2] | [A2] | 2.1 | A1A:6-AMINO HEXANOIC ACID | |||
2cej | [A2] | [A2] | [A2] | 2.5 | 1AH:3-AMINO-3-BENZYL-[4.3.0]BICYCLO-1,6-DIAZANONAN-2-ONE | |||
2cem | [A2] | [A2] | [A2] | 1.8 | 2AH:{(1S)-1-[N___sq___-[(2S)-2-HYDROXY-2-((1S,2R)-2-HYDROXY-INDAN-1-YLCARBAMOYL)-3-PHENYL-PROPYL]-N___sq___-[4-(PYRIDINE-2-YL)-BENZYL]-HYDRAZINOCARBONYL]-2,2-DIMETHYL-PROPYL}-CARBAMIC ACID METHYL ESTER | |||
2cen | [A2] | [A2] | [A2] | 1.7 | 4AH:{(1S)-1-[N___sq___-[(2S)-2-HYDROXY-2-((1S,2R)-2-HYDROXY-INDAN-1-YLCARBAMOYL)-3-PHENYL-PROPYL]-N___sq___-[4-(PYRIDINE-2-YL)-BENZYL]-HYDRAZINOCARBONYL]-2,2-DIMETHYL-PROPYL}-CARBAMIC ACID METHYL ESTER | |||
2er0 | [A][a] | [A][a] | [A][a] | 3 | CHS:4-AMINO-5-CYCLOHEXYL-3-HYDROXY-PENTANOIC ACID IVA:ISOVALERIC ACID | |||
2er6 | [A][a] | [A][a] | [A][a] | 2 | PUK:N-[(2S)-2-AMINO-3-PHENYLPROPYL]-L-PHENYLALANINE | |||
2er7 | [A][a] | [A][a] | [A][a] | 1.6 | BOC:TERT-BUTYL HYDROGEN CARBONATE LOV:5-AMINO-4-HYDROXY-2-ISOPROPYL-7-METHYL-OCTANOIC ACID SO4:SULFATE ION | |||
2er9 | [A][a] | [A][a] | [A][a] | 2.2 | BOC:TERT-BUTYL HYDROGEN CARBONATE STA:STATINE | |||
2ewy | [A] | [A] | [A] | 3.1 | DBO:N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHYLBENZYL)AMINO]PROPYL}DIBENZO[B,F]OXEPINE-10-CARBOXAMIDE | |||
2f3e | [A] | [A] | [A] | 2.11 | AXQ:{(E)-(3R,6S,9R)-3-[(1S,3R)-3-((S)-1 -BUTYLCARBAMOYL-2-METHYL-PROPYLCARB AMOYL)-1-HYDROXY-BUTYL]-6-METHYL-5,8-DIOXO-1,11-DITHIA-4,7-DIAZA-CYCLO PENTADEC-13-EN-9-YL}-CARBAMIC ACID TERT-BUTYL ESTER | |||
2f3f | [A] | [A] | [A] | 2.3 | AXF:(2R,4S)-N-BUTYL-4-HYDROXY-2-METHYL- 4-((E)-(4AS,12R,15S,17AS)-15-METHYL -14,17-DIOXO-2,3,4,4A,6,9,11,12,13, 14,15,16,17,17A-TETRADECAHYDRO-1H-5 ,10-DITHIA-1,13,16-TRIAZA-BENZOCYCL OPENTADECEN-12-YL)-BUTYRAMIDE | |||
2f3k | [A2] | [A2] | [A2] | 1.6 | PO4:PHOSPHATE ION RO1:(3S,4AS,8AS)-N-(TERT-BUTYL)-2-[(3S)-3-({3-(METHYLSULFONYL)-N-[(PYRIDIN-3-YLOXY)ACETYL]-L-VALYL}AMINO)-2-OXO-4-PHENYLBUTYL]DECAHYDROISOQUINOLINE-3-CARBOXAMIDE | |||
2f80 | [A2] | [A2] | [A2] | 1.45 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION SO4:SULFATE ION | |||
2f81 | [A2] | [A2] | [A2] | 1.25 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
2f8g | [A2] | [A2] | [A2] | 1.22 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACY:ACETIC ACID CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
2fdd | [A2] | [A2] | [A2] | 1.58 | 385:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-[(1,3-BENZODIOXOL-5-YLSULFONYL)(ISOBUTYL)AMINO]-2-HYDROXY-1-{4-[(2-METHYL-1,3-THIAZOL-4-YL)METHOXY]BENZYL}PROPYL]CARBAMATE | |||
2fde | [A2] | [A2] | [A2] | 2.7 | 385:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-[(1,3-BENZODIOXOL-5-YLSULFONYL)(ISOBUTYL)AMINO]-2-HYDROXY-1-{4-[(2-METHYL-1,3-THIAZOL-4-YL)METHOXY]BENZYL}PROPYL]CARBAMATE K:POTASSIUM ION | |||
2fdp | [A] | [A] | [A] | 2.5 | FRP:N1-((2S,3S,5R)-3-AMINO-6-(4-FLUOROPHENYLAMINO)-5-METHYL-6-OXO-1-PHENYLHEXAN-2-YL)-N3,N3-DIPROPYLISOPHTHALAMIDE | |||
2fgu | [A2] | [A2] | [A2] | 2 | ASN:ASPARAGINE DIQ:2-METHYL-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID HPH:(2S)-2-AMINO-3-PHENYLPROPANE-1,1-DIOL NTB:TERTIARY-BUTYLAMINE PO4:PHOSPHATE ION QNC:QUINOLINE-2-CARBOXYLIC ACID | |||
2fgv | [A2] | [A2] | [A2] | 1.5 | ASN:ASPARAGINE DIQ:2-METHYL-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID HPH:(2S)-2-AMINO-3-PHENYLPROPANE-1,1-DIOL NTB:TERTIARY-BUTYLAMINE PO4:PHOSPHATE ION QNC:QUINOLINE-2-CARBOXYLIC ACID | |||
2fiv | [A2][a2] | [A2][a2] | [A2][a2] | 2 | ACE:ACETYL GROUP ALN:NAPHTHALEN-2-YL-3-ALANINE NH2:AMINO GROUP SO4:SULFATE ION STA:STATINE | |||
2fle | [A2] | [A2] | [A2] | 1.9 | AI:(2S,2___sq___S)-N,N___sq___-[(2S,3S,4S,5S)-1-CYCLOHEXYL-3,4-DIHYDROXY-6-PHENYLHEXANE-2,5-DIYL]BIS[3-METHYL-2-({[METHYL(PYRIDIN-2-YLMETHYL)AMINO]CARBONYL}AMINO)BUTANAMIDE] GOL:GLYCEROL | |||
2fmb | [A2] | [A2] | [A2] | 1.8 | LP1:4-[2-(2-ACETYLAMINO-3-NAPHTALEN-1-YL-PROPIONYLAMINO)-4-METHYL-PENTANOYLAMINO]-3-HYDROXY-6-METHYL-HEPTANOICACID [1-(1-CARBAMOYL-2-NAPHTHALEN-1-YL-ETHYLCARBAMOYL)-PROPYL]-AMIDE | |||
2fns | [A2][a] | [A2][a] | [A2][a] | 1.85 | ACT:ACETATE ION PO4:PHOSPHATE ION | |||
2fnt | [A2][a] | [A2][a] | [A2][a] | 1.44 | ACT:ACETATE ION PO4:PHOSPHATE ION | |||
2fs4 | [A] | [A] | [A] | 2.2 | PZ1:(6R)-6-({[1-(3-HYDROXYPROPYL)-1,7-DIHYDROQUINOLIN-7-YL]OXY}METHYL)-1-(4-{3-[(2-METHOXYBENZYL)OXY]PROPOXY}PHENYL)PIPERAZIN-2-ONE | |||
2fxd | [A2] | [A2] | [A2] | 1.6 | ACT:ACETATE ION DR7:(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5, 6,10,13-PENTAAZATETRADECANEDIOICACID DIMETHYL ESTER SO4:SULFATE ION | |||
2fxe | [A2] | [A2] | [A2] | 1.8 | ACT:ACETATE ION DR7:(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5, 6,10,13-PENTAAZATETRADECANEDIOICACID DIMETHYL ESTER GOL:GLYCEROL SO4:SULFATE ION | |||
2g1n | [A] | [A] | [A] | 2.9 | 1IG:N-{2-[6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-2,2-DIMETHYL-3-OXO-2,3-DIHYDRO-4H-1,4-BENZOTHIAZIN-4-YL]ETHYL}ACETAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
2g1o | [A] | [A] | [A] | 2.7 | 2IG:6-ETHYL-5-[9-(3-METHOXYPROPYL)-9H-CARBAZOL-2-YL]PYRIMIDINE-2,4-DIAMINE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
2g1r | [A] | [A] | [A] | 2.42 | 3IG:N-{2-[6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-2,2-DIMETHYL-3-OXO-2,3-DIHYDRO-4H-1,4-BENZOXAZIN-4-YL]ETHYL}ACETAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
2g1s | [A] | [A] | [A] | 2.5 | 4IG:(2S)-6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-2-(3,5-DIFLUOROPHENYL)-4-(3-METHOXYPROPYL)-2H-1,4-BENZOXAZIN-3(4H)-ONE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
2g1y | [A] | [A] | [A] | 2.5 | 5IG:6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-4-(3-METHOXYPROPYL)-2,2-DIMETHYL-2H-1,4-BENZOXAZIN-3(4H)-ONE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
2g20 | [A] | [A] | [A] | 2.4 | L1A:N-(MORPHOLIN-4-YLSULFONYL)-L-PHENYLALANYL-3-(2-AMINO-1,3-THIAZOL-4-YL)-N-{(1R,2R,3S)-1-[(1R)-CYCLOHEX-3-EN-1-YLMETHYL]-2,3-DIHYDROXY-5-METHYLHEXYL}-L-ALANINAMIDE | |||
2g21 | [A] | [A] | [A] | 2.2 | L1B:7-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-1-(3-METHOXYPROPYL)QUINOLINIUM | |||
2g22 | [A] | [A] | [A] | 2.5 | 6IG:6-ETHYL-5-[1-(3-METHOXYPROPYL)-1,2,3,4-TETRAHYDROQUINOLIN-7-YL]-N~4~-(2-PHENYLETHYL)PYRIMIDINE-2,4-DIAMINE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
2g24 | [A] | [A] | [A] | 1.9 | 7IG:5-{4-[(3,5-DIFLUOROBENZYL)AMINO]PHENYL}-6-ETHYLPYRIMIDINE-2,4-DIAMINE | |||
2g26 | [A] | [A] | [A] | 2.1 | 3LG:(5-{[(2R)-1-(4-{3-[(2-METHOXYBENZYL)OXY]PROPOXY}PHENYL)-6-OXOPIPERAZIN-2-YL]METHOXY}-1H-INDOL-1-YL)ACETIC ACID | |||
2g27 | [A] | [A] | [A] | 2.9 | 4LG:METHYL (6-{[(2R)-1-(4-{3-[(2-METHOXYBENZYL)OXY]PROPOXY}PHENYL)-6-OXOPIPERAZIN-2-YL]METHOXY}-1H-INDOL-1-YL)ACETATE | |||
2g69 | [A2] | [A2] | [A2] | 1.35 | ||||
2g94 | [A] | [A] | [A] | 1.86 | ZPQ:N~2~-[(2R,4S,5S)-5-{[N-{[(3,5-DIMETHYL-1H-PYRAZOL-1-YL)METHOXY]CARBONYL}-3-(METHYLSULFONYL)-L-ALANYL]AMINO}-4-HYDROXY-2,7-DIMETHYLOCTANOYL]-N-ISOBUTYL-L-VALINAMIDE | |||
2h6s | [A] | [A] | [A] | 2.2 | ZN:ZINC ION | |||
2h6t | [A][a] | [A][a] | [A][a] | 1.9 | IVA:ISOVALERIC ACID STA:STATINE ZN:ZINC ION | |||
2hah | [A2] | [A2] | [A2] | 1.7 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE | |||
2hb2 | [A2] | [A2] | [A2] | 2.3 | ||||
2hb3 | [A2] | [A2] | [A2] | 1.35 | CL:CHLORIDE ION GOL:GLYCEROL GRL:(3AS,5R,6AR)-HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL (2S,3S)-3-HYDROXY-4-(4-(HYDROXYMETHYL)-N-ISOBUTYLPHENYLSULFONAMIDO)-1-PHENYLBUTAN-2-YLCARBAMATE NA:SODIUM ION | |||
2hb4 | [A2] | [A2] | [A2] | 2.15 | MG:MAGNESIUM ION PGR:R-1,2-PROPANEDIOL | |||
2hc0 | [A2] | [A2] | [A2] | 1.3 | AB2:[1-((1S,2R)-1-BENZYL-2-HYDROXY-3-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}PROPYL)-1H-1,2,3-TRIAZOL-4-YL]METHYL (1R,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YLCARBAMATE BR:BROMIDE ION | |||
2hiz | [A] | [A] | [A] | 2.5 | LIJ:BENZYL [(1S)-2-({(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}AMINO)-2-OXO-1-{[(1-PROPYLBUTYL)SULFONYL]METHYL}ETHYL]CARBAMATE PO4:PHOSPHATE ION | |||
2hm1 | [A] | [A] | [A] | 2.2 | LIQ:N-{(1S)-2-({(1S,2R)-1-(3,5-DIFLUOROBENZYL)-3-[(3-ETHYLBENZYL)AMINO]-2-HYDROXYPROPYL}AMINO)-2-OXO-1-[(PENTYLSULFONYL)METHYL]ETHYL}NICOTINAMIDE | |||
2hpe | [A2] | [A2] | [A2] | 2 | ||||
2hpf | [A2] | [A2] | [A2] | 3 | ||||
2hs1 | [A2] | [A2] | [A2] | 0.84 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE | |||
2hs2 | [A2] | [A2] | [A2] | 1.22 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE | |||
2i0a | [A2] | [A2] | [A2] | 1.8 | GOL:GLYCEROL MUI:(5S)-3-(4-ACETYLPHENYL)-N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}PROPYL]-2-OXO-1,3-OXAZOLIDINE-5-CARBOXAMIDE PO4:PHOSPHATE ION | |||
2i0d | [A2] | [A2] | [A2] | 1.95 | ACT:ACETATE ION MUT:(5S)-3-(3-ACETYLPHENYL)-N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}PROPYL]-2-OXO-1,3-OXAZOLIDINE-5-CARBOXAMIDE PO4:PHOSPHATE ION | |||
2i1a | [A2] | [A2] | [A2] | 2.3 | ||||
2i4d | [A2] | [A2] | [A2] | 1.5 | QFI:({4-[(2S,3R)-2-({[(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YLOXY]CARBONYL}AMINO)-3-HYDROXY-4-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}BUTYL]PHENOXY}METHYL)PHOSPHONIC ACID | |||
2i4q | [A2] | [A2] | [A2] | 2.3 | UA4:(2S)-6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-2-(3,5-DIFLUOROPHENYL)-4-(3-METHOXYPROPYL)-2-METHYL-2H-1,4-BENZOXAZIN-3(4H)-ONE | |||
2i4u | [A2] | [A2] | [A2] | 1.5 | DJR:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}PROPYL]CARBAMATE | |||
2i4v | [A2] | [A2] | [A2] | 1.5 | DJR:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}PROPYL]CARBAMATE | |||
2i4w | [A2] | [A2] | [A2] | 1.55 | KGQ:DIETHYL ({4-[(2S,3R)-2-({[(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YLOXY]CARBONYL}AMINO)-3-HYDROXY-4-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}BUTYL]PHENOXY}METHYL)PHOSPHONATE | |||
2i4x | [A2] | [A2] | [A2] | 1.55 | KGQ:DIETHYL ({4-[(2S,3R)-2-({[(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YLOXY]CARBONYL}AMINO)-3-HYDROXY-4-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}BUTYL]PHENOXY}METHYL)PHOSPHONATE | |||
2idw | [A2] | [A2] | [A2] | 1.1 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACY:ACETIC ACID CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PO4:PHOSPHATE ION | |||
2ien | [A2] | [A2] | [A2] | 1.3 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACY:ACETIC ACID CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
2ieo | [A2] | [A2] | [A2] | 1.53 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION NA:SODIUM ION | |||
2igx | [A] | [A] | [A] | 1.7 | A1T:5-PENTYL-N-{[4___sq___-(PIPERIDIN-1-YLCARBONYL)BIPHENYL-4-YL]METHYL}-N-[1-(PYRIDIN-2-YLMETHYL)PIPERIDIN-4-YL]PYRIDINE-2-CARBOXAMIDE | |||
2igy | [A] | [A] | [A] | 2.6 | A2T:N-[1-(3-METHYLBUTYL)PIPERIDIN-4-YL]-N-{4-[METHYL(PYRIDIN-4-YL)AMINO]BENZYL}-4-PENTYLBENZAMIDE | |||
2iko | [A6] | [A6] | [A6] | 1.9 | 7IG:5-{4-[(3,5-DIFLUOROBENZYL)AMINO]PHENYL}-6-ETHYLPYRIMIDINE-2,4-DIAMINE | |||
2iku | [A6] | [A6] | [A6] | 2.6 | LIY:6-ETHYL-5-[(2S)-1-(3-METHOXYPROPYL)-2-PHENYL-1,2,3,4-TETRAHYDROQUINOLIN-7-YL]PYRIMIDINE-2,4-DIAMINE | |||
2il2 | [A6] | [A6] | [A6] | 2.24 | CIT:CITRIC ACID LIX:N-[2-({2-AMINO-6-ETHYL-5-[4-(3-METHOXYPROPYL)-2,2-DIMETHYL-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-6-YL]PYRIMIDIN-4-YL}AMINO)ETHYL]NAPHTHALENE-2-SULFONAMIDE | |||
2iqg | [A] | [A] | [A] | 1.7 | F2I:N___sq___-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-3-[(3-IODOBENZYL)AMINO]PROPYL}-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE | |||
2irz | [A] | [A] | [A] | 1.8 | I02:3-{5-[(1R)-1-AMINO-1-METHYL-2-PHENYLETHYL]-1,3,4-OXADIAZOL-2-YL}-N-[(1R)-1-(4-FLUOROPHENYL)ETHYL]-5-[METHYL(METHYLSULFONYL)AMINO]BENZAMIDE | |||
2is0 | [A] | [A] | [A] | 2.2 | I03:(2S)-2-AMINO-2-BENZYL-3-HYDROXYPROPYL 3-({[(1R)-1-(4-FLUOROPHENYL)ETHYL]AMINO}CARBONYL)-5-[METHYL(METHYLSULFONYL)AMINO]BENZOATE | |||
2j9j | [AB][a] | [A2][a] | [A2][a] | 1.04 | ABA:ALPHA-AMINOBUTYRIC ACID ACT:ACETATE ION GOL:GLYCEROL JG3:1-[(2S,3S)-3-AMINO-2-HYDROXY-4-PHENYLBUTYL]-L-PROLINE NLE:NORLEUCINE SLZ:L-THIALYSINE SO4:SULFATE ION VME:METHYL L-VALINATE | |||
2j9k | [A2] | [A2] | [A2] | 1.2 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID ACT:ACETATE ION GOL:GLYCEROL NLE:NORLEUCINE SLZ:L-THIALYSINE SO4:SULFATE ION | |||
2je4 | [A2][a] | [A2][a] | [A2][a] | 1.07 | ACT:ACETATE ION DBU:(2Z)-2-AMINOBUT-2-ENOIC ACID GOL:GLYCEROL JG3:1-[(2S,3S)-3-AMINO-2-HYDROXY-4-PHENYLBUTYL]-L-PROLINE NLE:NORLEUCINE SO4:SULFATE ION VME:METHYL L-VALINATE | |||
2jji | [A] | [A] | [A] | 1.57 | 0QS:N~2~-[(2R)-2-BENZYL-3-(TERT-BUTYLSULFONYL)PROPANOYL]-N-{(1R)-1-(CYCLOHEXYLMETHYL)-3,3-DIFLUORO-2,2-DIHYDROXY-4-[(2-MORPHOLIN-4-YLETHYL)AMINO]-4-OXOBUTYL}-3-(1H-IMIDAZOL-3-IUM-4-YL)-L-ALANINAMIDE SO4:SULFATE ION SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
2jjj | [A] | [A] | [A] | 1 | 0QS:N~2~-[(2R)-2-BENZYL-3-(TERT-BUTYLSULFONYL)PROPANOYL]-N-{(1R)-1-(CYCLOHEXYLMETHYL)-3,3-DIFLUORO-2,2-DIHYDROXY-4-[(2-MORPHOLIN-4-YLETHYL)AMINO]-4-OXOBUTYL}-3-(1H-IMIDAZOL-3-IUM-4-YL)-L-ALANINAMIDE SO4:SULFATE ION SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
2jxr | [A] | [A] | [A] | 2.4 | 2Z3:N-(MORPHOLIN-4-YLCARBONYL)-L-PHENYLALANYL-N-[(1R)-1-(CYCLOHEXYLMETHYL)-3,3-DIFLUORO-2,2-DIHYDROXY-4-(METHYLAMINO)-4-OXOBUTYL]-L-NORLEUCINAMIDE BMA:BETA-D-MANNOPYRANOSE MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
2jys | [A] | [A] | [A] | NOTAPPLICABLE. | ||||
2mip | [A2][a2] | [A2][a2] | [A2][a2] | 2.2 | NH2:AMINO GROUP | |||
2nmy | [A2] | [A2] | [A2] | 1.1 | CL:CHLORIDE ION NA:SODIUM ION ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1 -PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE SO4:SULFATE ION | |||
2nmz | [A2] | [A2] | [A2] | 0.97 | ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1 -PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE SO4:SULFATE ION | |||
2nnk | [A2] | [A2] | [A2] | 1.25 | ACY:ACETIC ACID CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1 -PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
2nnp | [A2] | [A2] | [A2] | 1.2 | ACY:ACETIC ACID GOL:GLYCEROL ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1 -PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE SO4:SULFATE ION | |||
2nph | [A2][ab] | [A2][ab] | [A2][ab] | 1.65 | ||||
2nr6 | [ABC] | [ABC] | [A2B] | 2.81 | CSX:S-OXY CYSTEINE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE ZN:ZINC ION | |||
2ntr | [A] | [A] | [A] | 1.8 | L00:(2R)-2-(5-{3-CHLORO-6-((2-METHOXYETHYL){[(1S,2S)-2-METHYLCYCLOPROPYL]METHYL}AMINO)-2-[METHYL(METHYLSULFONYL)AMINO]PYRID IN-4-YL}-1,3,4-OXADIAZOL-2-YL)-1-PHENYLPROPAN-2-AMINE | |||
2nxd | [A2][a] | [A2][a] | [A2][a] | 2 | ||||
2nxl | [A2][a] | [A2][a] | [A2][a] | 2 | PO4:PHOSPHATE ION | |||
2nxm | [A2][a] | [A2][a] | [A2][a] | 2.25 | ||||
2o40 | [A] | [A] | [A] | 1.65 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID NLE:NORLEUCINE YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
2o4k | [A2] | [A2] | [A2] | 1.6 | CL:CHLORIDE ION DR7:(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5, 6,10,13-PENTAAZATETRADECANEDIOICACID DIMETHYL ESTER | |||
2o4l | [A2] | [A2] | [A2] | 1.33 | CL:CHLORIDE ION GOL:GLYCEROL TPV:N-(3-{(1R)-1-[(6R)-4-HYDROXY-2-OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO-2H-PYRAN-3-YL]PROPYL}PHENYL)-5-(TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE | |||
2o4n | [A2] | [A2] | [A2] | 2 | GOL:GLYCEROL TPV:N-(3-{(1R)-1-[(6R)-4-HYDROXY-2-OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO-2H-PYRAN-3-YL]PROPYL}PHENYL)-5-(TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE | |||
2o4p | [A2] | [A2] | [A2] | 1.8 | GOL:GLYCEROL TPV:N-(3-{(1R)-1-[(6R)-4-HYDROXY-2-OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO-2H-PYRAN-3-YL]PROPYL}PHENYL)-5-(TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE | |||
2o4s | [A2] | [A2] | [A2] | 1.54 | AB1:N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE CL:CHLORIDE ION GOL:GLYCEROL | |||
2oah | [A2] | [A2] | [A2] | 1.8 | QIN:N-[(1S,2S)-2-AMINO-1-(3-THIENYLMETHYL)HEXYL]-2-({[(1S,2S)-2-METHYLCYCLOPROPYL]METHYL}AMINO)-6-[METHYL(METHYLSULFONYL)AMINO]ISONICOTINAMIDE | |||
2of0 | [A] | [A] | [A] | 2.25 | CMZ:(2S)-1-(2,5-DIMETHYLPHENOXY)-3-MORPHOLIN-4-YLPROPAN-2-OL DMS:DIMETHYL SULFOXIDE IOD:IODIDE ION | |||
2ohk | [A] | [A] | [A] | 2.2 | 1SQ:ISOQUINOLIN-1-AMINE DMS:DIMETHYL SULFOXIDE IOD:IODIDE ION | |||
2ohl | [A] | [A] | [A] | 2.65 | 2AQ:QUINOLIN-2-AMINE DMS:DIMETHYL SULFOXIDE IOD:IODIDE ION | |||
2ohm | [A] | [A] | [A] | 2.7 | 8AP:N~3~-BENZYLPYRIDINE-2,3-DIAMINE DMS:DIMETHYL SULFOXIDE IOD:IODIDE ION | |||
2ohn | [A] | [A] | [A] | 2.15 | 4FP:4-(4-FLUOROBENZYL)PIPERIDINE DMS:DIMETHYL SULFOXIDE IOD:IODIDE ION | |||
2ohp | [A] | [A] | [A] | 2.25 | 6IP:6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-2-AMINE DMS:DIMETHYL SULFOXIDE IOD:IODIDE ION | |||
2ohq | [A] | [A] | [A] | 2.1 | 7IP:6-[2-(3___sq___-METHOXYBIPHENYL-3-YL)ETHYL]PYRIDIN-2-AMINE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL IOD:IODIDE ION | |||
2ohr | [A] | [A] | [A] | 2.25 | 8IP:N~3~-(3-PYRIDIN-3-YLBENZYL)PYRIDINE-2,3-DIAMINE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL IOD:IODIDE ION | |||
2ohs | [A] | [A] | [A] | 2.45 | 9IP:N~3~-[3-(5-METHOXYPYRIDIN-3-YL)BENZYL]PYRIDINE-2,3-DIAMINE DMS:DIMETHYL SULFOXIDE IOD:IODIDE ION | |||
2oht | [A] | [A] | [A] | 2.3 | DMS:DIMETHYL SULFOXIDE IOD:IODIDE ION IP6:N~3~-[3-(1H-INDOL-6-YL)BENZYL]PYRIDINE-2,3-DIAMINE | |||
2ohu | [A] | [A] | [A] | 2.35 | DMS:DIMETHYL SULFOXIDE IOD:IODIDE ION IP7:N~3~-[5-(1H-INDOL-6-YL)-2-(PYRIDIN-2-YLMETHOXY)BENZYL]PYRIDINE-2,3-DIAMINE | |||
2p3a | [A2] | [A2] | [A2] | 1.75 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE CME:S,S-(2-HYDROXYETHYL)THIOCYSTEINE | |||
2p3b | [AB] | [A2] | [A2] | 2.1 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE CME:S,S-(2-HYDROXYETHYL)THIOCYSTEINE | |||
2p3c | [A2] | [A2] | [A2] | 2.1 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE ACY:ACETIC ACID CME:S,S-(2-HYDROXYETHYL)THIOCYSTEINE | |||
2p3d | [A2] | [A2] | [A2] | 2.8 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE | |||
2p4j | [A] | [A] | [A] | 2.5 | 23I:N-[(1S,2S,4R)-2-HYDROXY-1-ISOBUTYL-5-({(1S)-1-[(ISOPROPYLAMINO)CARBONYL]-2-METHYLPROPYL}AMINO)-4-METHYL-5-OXOPENTYL]-5-[METHYL(METHYLSULFONYL)AMINO]-N___sq___-[(1R)-1-PHENYLETHYL]ISOPHTHALAMIDE | |||
2p83 | [A] | [A] | [A] | 2.5 | MR0:N~3~-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-N~1~,N~1~-DIPROPYLBENZENE-1,3,5-TRICARBOXAMIDE PO4:PHOSPHATE ION | |||
2p8h | [A] | [A] | [A] | 1.8 | MY9:N-{(1S,2S)-1-BENZYL-2-HYDROXY-2-[(4S)-1,2,2-TRIMETHYL-5-OXOIMIDAZOLIDIN-4-YL]ETHYL}-N___sq___-[(1R)-1-(4-FLUOROPHENYL)ETHYL]-5-[METHYL(METHYLSULFONYL)AMINO]ISOPHTHALAMIDE | |||
2pc0 | [A2] | [A2] | [A2] | 1.4 | MG:MAGNESIUM ION PGR:R-1,2-PROPANEDIOL | |||
2ph6 | [A] | [A] | [A] | 2 | 712:3-({[(1R)-1-(4-FLUOROPHENYL)ETHYL]AMINO}CARBONYL)-5-[METHYL(METHYLSULFONYL)AMINO]BENZYL ALPHA-METHYL-D-PHENYLALANINATE SO4:SULFATE ION | |||
2ph8 | [A] | [A] | [A] | 1.7 | 35A:N-[(5R,14R)-5-AMINO-5,14-DIMETHYL-4-OXO-3-OXA-18-AZATRICYCLO[15.3.1.1~7,11~]DOCOSA-1(21),7(22),8,10,17,19-HEXAEN-19-YL]-N-METHYLMETHANESULFONAMIDE SO4:SULFATE ION | |||
2pk5 | [A2] | [A2] | [A2] | 1.9 | 075:(4R)-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-3-[(2S,3S)-2-HYDROXY-3-({N-[(ISOQUINOLIN-5-YLOXY)ACETYL]-3-(METHYL SULFONYL)-L-ALANYL}AMINO)-4-PHENYLBUTANOYL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE GOL:GLYCEROL | |||
2pk6 | [A2] | [A2] | [A2] | 1.45 | GOL:GLYCEROL O33:(4R)-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-3-[(2S,3S)-2-HYDROXY-3-({N-[(ISOQUINOLIN-5-YLOXY)ACETYL]-S-METHYL- L-CYSTEINYL}AMINO)-4-PHENYLBUTANOYL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
2pma | [A] | [A] | [A] | 1.89 | ACT:ACETATE ION FMT:FORMIC ACID | |||
2pqz | [A2] | [A2] | [A2] | 1.55 | CL:CHLORIDE ION G0G:N,N___sq___-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(N-BENZYLBENZENESULFONAMIDE) | |||
2psg | [A2] | [A2] | [A2] | 1.8 | SEP:PHOSPHOSERINE | |||
2psu | [A2] | [A2] | [A2] | 1.93 | ACT:ACETATE ION MUU:N-[(1S,2R)-1-BENZYL-3-{(CYCLOPROPYLMETHYL)[(3-METHOXYPHENYL)SULFONYL]AMINO}-2-HYDROXYPROPYL]-N___sq___-METHYLSUCCINAMIDE PO4:PHOSPHATE ION | |||
2psv | [A2] | [A2] | [A2] | 1.75 | ACT:ACETATE ION MUV:N-{(1S,2R)-1-BENZYL-3-[(CYCLOPROPYLMETHYL)(2-FURYLSULFONYL)AMINO]-2-HYDROXYPROPYL}-N___sq___-METHYLSUCCINAMIDE PO4:PHOSPHATE ION | |||
2pwc | [A2] | [A2] | [A2] | 1.78 | CL:CHLORIDE ION G3G:N,N___sq___-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-AMINO-N-BENZYLBENZENESULFONAMIDE) GOL:GLYCEROL | |||
2pwr | [A2] | [A2] | [A2] | 1.5 | CL:CHLORIDE ION G4G:4,4___sq___-{(3S,4S)-PYRROLIDINE-3,4-DIYLBIS[(BENZYLIMINO)SULFONYL]}DIBENZAMIDE GOL:GLYCEROL | |||
2pym | [A2] | [A2] | [A2] | 1.9 | 1UN:2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL SULFANYL-BUTYL]-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID TERT-BUTYLAMIDE | |||
2pyn | [A2] | [A2] | [A2] | 1.85 | 1UN:2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL SULFANYL-BUTYL]-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID TERT-BUTYLAMIDE | |||
2q11 | [A] | [A] | [A] | 2.4 | XX4:3-(2-AMINO-6-BENZOYLQUINAZOLIN-3(4H)-YL)-N-CYCLOHEXYL-N-METHYLPROPANAMIDE | |||
2q15 | [A2] | [A2] | [A2] | 2.4 | 3MR:(4S)-4-(2-AMINO-6-PHENOXYQUINAZOLIN-3(4H)-YL)-N,4-DICYCLOHEXYL-N-METHYLBUTANAMIDE | |||
2q3k | [A2] | [A2] | [A2] | 2 | ACT:ACETATE ION MUW:N-{(5S)-5-[{[4-(AMINOMETHYL)PHENYL]SULFONYL}(ISOBUTYL)AMINO]-6-HYDROXYHEXYL}-NALPHA-(METHOXYCARBONYL)-BETA-PHENYL-L-PHENYLALANINAMIDE PO4:PHOSPHATE ION | |||
2q54 | [A2] | [A2] | [A2] | 1.85 | ACT:ACETATE ION MU1:N~2~-ACETYL-N-[(1S,3S,4S)-4-({[(5S)-3-(3-ACETYLPHENYL)-2-OXO-1,3-OXAZOLIDIN-5-YL]CARBONYL}AMINO)-1-BENZYL-3-HYDROXY-5-PHENYLPENTYL]-L-VALINAMIDE PO4:PHOSPHATE ION | |||
2q55 | [A2] | [A2] | [A2] | 1.9 | MU0:(5S)-N-[(1S,2S,4S)-1-BENZYL-2-HYDROXY-4-{[(2S)-3-METHYL-2-(2-OXOTETRAHYDROPYRIMIDIN-1(2H)-YL)BUTANOYL]AMINO}-5-PHENYLPENTYL]-2-OXO-3-PHENYL-1,3-OXAZOLIDINE-5-CARBOXAMIDE PO4:PHOSPHATE ION | |||
2q5k | [A2] | [A2] | [A2] | 1.95 | AB1:N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE PO4:PHOSPHATE ION | |||
2q63 | [A2] | [A2] | [A2] | 2.2 | 1UN:2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL SULFANYL-BUTYL]-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID TERT-BUTYLAMIDE | |||
2q64 | [A2] | [A2] | [A2] | 2.5 | 1UN:2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL SULFANYL-BUTYL]-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID TERT-BUTYLAMIDE | |||
2qak | [A2] | [A2] | [A2] | 2.2 | 1UN:2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL SULFANYL-BUTYL]-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID TERT-BUTYLAMIDE | |||
2qci | [A2] | [A2] | [A2] | 1.2 | 065:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(2S,3R)-3-HYDROXY-4-(N-ISOBUTYLBENZO[D][1,3]DIOXOLE-5-SULFONAMIDO)-1-PHENYLBUTAN-2-YLCARBAMATE ACT:ACETATE ION CL:CHLORIDE ION NA:SODIUM ION | |||
2qd6 | [A2] | [A2] | [A2] | 1.28 | 065:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(2S,3R)-3-HYDROXY-4-(N-ISOBUTYLBENZO[D][1,3]DIOXOLE-5-SULFONAMIDO)-1-PHENYLBUTAN-2-YLCARBAMATE ACT:ACETATE ION CL:CHLORIDE ION NA:SODIUM ION | |||
2qd7 | [A2] | [A2] | [A2] | 1.11 | 065:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(2S,3R)-3-HYDROXY-4-(N-ISOBUTYLBENZO[D][1,3]DIOXOLE-5-SULFONAMIDO)-1-PHENYLBUTAN-2-YLCARBAMATE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PO4:PHOSPHATE ION | |||
2qd8 | [A2] | [A2] | [A2] | 1.35 | 065:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(2S,3R)-3-HYDROXY-4-(N-ISOBUTYLBENZO[D][1,3]DIOXOLE-5-SULFONAMIDO)-1-PHENYLBUTAN-2-YLCARBAMATE ACT:ACETATE ION CL:CHLORIDE ION NA:SODIUM ION | |||
2qhc | [A2] | [A2] | [A2] | 2.8 | AB1:N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE BME:BETA-MERCAPTOETHANOL | |||
2qhy | [A2] | [A2] | [A2] | 1.85 | ACT:ACETATE ION MZ1:N~2~-ACETYL-N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{(2-THIENYLMETHYL)[(2,4,5-TRIFLUOROPHENYL)SULFONYL]AMINO}PROPYL]-L-ALANINAMIDE PO4:PHOSPHATE ION | |||
2qhz | [A2] | [A2] | [A2] | 1.85 | MZ2:(2E)-N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{(2-THIENYLMETHYL)[(2,4,5-TRIFLUOROPHENYL)SULFONYL]AMINO}PROPYL]-4,4,4-TRIFLUORO-3-METHYLBUT-2-ENAMIDE PO4:PHOSPHATE ION | |||
2qi0 | [A2] | [A2] | [A2] | 2.1 | MZ3:N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(3-METHOXYPHENYL)SULFONYL](2-THIENYLMETHYL)AMINO}PROPYL]-3-FLUORO-2-METHYLBENZAMIDE PO4:PHOSPHATE ION | |||
2qi1 | [A2] | [A2] | [A2] | 2 | MZ4:N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(3-METHOXYPHENYL)SULFONYL](2-THIENYLMETHYL)AMINO}PROPYL]-3,4-DIHYDROXYBENZAMIDE PO4:PHOSPHATE ION | |||
2qi3 | [A2] | [A2] | [A2] | 1.95 | MZ5:(2S)-N-[(1S,2R)-3-{(1,3-BENZOTHIAZOL-6-YLSULFONYL)[(2S)-2-METHYLBUTYL]AMINO}-1-BENZYL-2-HYDROXYPROPYL]-2-HYDROXY-3-METHYLBUTANAMIDE PO4:PHOSPHATE ION | |||
2qi4 | [A2] | [A2] | [A2] | 1.8 | ACT:ACETATE ION MZ6:N-[(1S,2R)-3-{(1,3-BENZOTHIAZOL-6-YLSULFONYL)[(2S)-2-METHYLBUTYL]AMINO}-1-BENZYL-2-HYDROXYPROPYL]-3-HYDROXYBENZAMIDE PO4:PHOSPHATE ION | |||
2qi5 | [A2] | [A2] | [A2] | 1.85 | MZ7:N~2~-ACETYL-N-{(1S,2R)-3-[(1,3-BENZOTHIAZOL-6-YLSULFONYL)(PENTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYL}-L-VALINAMIDE PO4:PHOSPHATE ION | |||
2qi6 | [A2] | [A2] | [A2] | 1.85 | MZ8:N-{(1S,2R)-3-[(1,3-BENZOTHIAZOL-6-YLSULFONYL)(ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYL}-3-HYDROXYBENZAMIDE PO4:PHOSPHATE ION | |||
2qi7 | [A2] | [A2] | [A2] | 1.85 | ACT:ACETATE ION MZ9:N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL][(2S)-2-METHYLBUTYL]AMINO}PROPYL]-4-OXOHEXANAMIDE PO4:PHOSPHATE ION | |||
2qk5 | [A] | [A] | [A] | 2.2 | CS5:N___sq___-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE | |||
2qmd | [A] | [A] | [A] | 1.65 | CS7:N___sq___-[(1S,2R)-2-[(2R,4R)-4-(BENZYLOXY)PYRROLIDIN-2-YL]-1-(3,5-DIFLUOROBENZYL)-2-HYDROXYETHYL]-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE TAR:D(-)-TARTARIC ACID | |||
2qmf | [A] | [A] | [A] | 1.75 | CS9:N___sq___-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-2-[(2R,4R)-4-PHENOXYPYRROLIDIN-2-YL]ETHYL}-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE TAR:D(-)-TARTARIC ACID | |||
2qmg | [A] | [A] | [A] | 1.89 | SC6:N-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-2-[(2R,4R)-4-PHENOXYPYRROLIDIN-2-YL]ETHYL}-3-{[(2R)-2-(METHOXYMETHYL)PYRROLIDIN-1-YL]CARBONYL}-5-METHYLBENZAMIDE TAR:D(-)-TARTARIC ACID | |||
2qmp | [A2] | [A2] | [A2] | 1.8 | A00:N-[(5S)-5-{[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO}-6-HYDROXYHEXYL]-NALPHA-(METHOXYCARBONYL)-BETA-PHENYL-L-PHENYLALANINAMIDE | |||
2qnn | [A2] | [A2] | [A2] | 1.48 | CL:CHLORIDE ION GOL:GLYCEROL QN1:4,4___sq___-[(3S,4S)-PYRROLIDINE-3,4-DIYLBIS({[4-(TRIFLUOROMETHYL)BENZYL]IMINO}SULFONYL)]DIBENZAMIDE | |||
2qnp | [A2] | [A2] | [A2] | 1.41 | CL:CHLORIDE ION QN2:N,N___sq___-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS[N-(4-IODOBENZYL)BENZENESULFONAMIDE] | |||
2qnq | [A2] | [A2] | [A2] | 2.3 | CL:CHLORIDE ION QN3:N,N___sq___-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(N-BENZYL-2-CHLOROBENZENESULFONAMIDE) | |||
2qp8 | [A] | [A] | [A] | 1.5 | SC7:N___sq___-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-[(2R,4S)-4-ETHOXYPIPERIDIN-2-YL]-2-HYDROXYETHYL}-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE TAR:D(-)-TARTARIC ACID | |||
2qu2 | [A] | [A] | [A] | 2.6 | 251:N-[AMINO(IMINO)METHYL]-2-(2,5-DIPHENYL-1H-PYRROL-1-YL)ACETAMIDE | |||
2qu3 | [A] | [A] | [A] | 2 | 462:N-[AMINO(IMINO)METHYL]-2-[2-(2-CHLOROPHENYL)-4-(4-PROPOXYPHENYL)-3-THIENYL]ACETAMIDE | |||
2qzk | [A] | [A] | [A] | 1.8 | I21:2-[(5R)-5-AMINO-5-METHYL-4,16-DIOXO-14-PHENYL-3-OXA-15-AZATRICYCLO[15.3.1.1~7,11~]DOCOSA-1(21),7(22),8,10,12,14,17,19-OCTAEN-19-YL]BENZONITRILE | |||
2qzl | [A] | [A] | [A] | 1.8 | IXS:N-[(1S)-1-BENZYL-2-{[(1S)-2-(ISOBUTYLAMINO)-1-METHYL-2-OXOETHYL]AMINO}ETHYL]-N___sq___-[(1R)-1-(4-FLUOROPHENYL)ETHYL]-5-[METHYL(METHYLSULFONYL)AMINO]ISOPHTHALAMIDE | |||
2qzw | [A] | [A] | [A] | 2.05 | ||||
2qzx | [A][a] | [A][a] | [A][a] | 2.5 | IVA:ISOVALERIC ACID STA:STATINE | |||
2r38 | [A2] | [A2] | [A2] | 1.81 | CL:CHLORIDE ION G4G:4,4___sq___-{(3S,4S)-PYRROLIDINE-3,4-DIYLBIS[(BENZYLIMINO)SULFONYL]}DIBENZAMIDE | |||
2r3t | [A2] | [A2] | [A2] | 1.8 | CL:CHLORIDE ION G4G:4,4___sq___-{(3S,4S)-PYRROLIDINE-3,4-DIYLBIS[(BENZYLIMINO)SULFONYL]}DIBENZAMIDE | |||
2r3w | [A2] | [A2] | [A2] | 1.92 | CL:CHLORIDE ION G3G:N,N___sq___-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-AMINO-N-BENZYLBENZENESULFONAMIDE) | |||
2r43 | [A2] | [A2] | [A2] | 1.58 | CL:CHLORIDE ION G3G:N,N___sq___-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-AMINO-N-BENZYLBENZENESULFONAMIDE) GOL:GLYCEROL | |||
2r5p | [A2] | [A2] | [A2] | 2.3 | CL:CHLORIDE ION MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE NA:SODIUM ION | |||
2r5q | [A2] | [A2] | [A2] | 2.3 | 1UN:2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL SULFANYL-BUTYL]-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID TERT-BUTYLAMIDE | |||
2r8n | [A2] | [A2] | [A2] | 1.2 | GOL:GLYCEROL | |||
2r9b | [A][a] | [A][a] | [A][a] | 2.8 | DCL:2-AMINO-4-METHYL-PENTAN-1-OL | |||
2ren | [A] | [A] | [A] | 2.5 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
2rkf | [A2] | [A2] | [A2] | 1.8 | AB1:N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE GOL:GLYCEROL SO4:SULFATE ION | |||
2rkg | [A2] | [A2] | [A2] | 1.8 | AB1:N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE GOL:GLYCEROL | |||
2rmp | [A][a] | [A][a] | [A][a] | 2.7 | BMA:BETA-D-MANNOPYRANOSE IVA:ISOVALERIC ACID NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE STA:STATINE | |||
2rsp | [A2] | [A2] | [A2] | 2 | ||||
2sam | [A2] | [A2] | [A2] | 2.4 | EPN:3-(4-NITRO-PHENOXY)-PROPAN-1-OL | |||
2upj | [A2] | [A2] | [A2] | 3 | U02:[2-(3-{[6-(1-BENZYL-PROPYL)-4-HYDROXY-2-OXO-2H-PYRAN-3-YL]-CYCLOPROPYL-METHYL}-PHENYLCARBAMOYL)-ETHYL]-CARBAMIC ACID TERT-BUTYL ESTER | |||
2uxz | [A2] | [A2] | [A2] | 1.75 | HI1:METHYL [(1S)-1-({2-[(4R)-4-BENZYL-4-HYDROXY-5-{[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]AMINO}-5-OXOPENTYL]-2-(4-BROMOBENZYL)HYDRAZINO}CARBONYL)-2,2-DIMETHYLPROPYL]CARBAMATE | |||
2uy0 | [A2] | [A2] | [A2] | 1.76 | HV1:METHYL [(1S)-1-({2-[(4R)-4-BENZYL-4-HYDROXY-5-{[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]AMINO}-5-OXOPENTANOYL]-2-(4-BROMOBENZYL)HYDRAZINO}CARBONYL)-2,2-DIMETHYLPROPYL]CARBAMATE | |||
2v00 | [A] | [A] | [A] | 1.55 | ACT:ACETATE ION GOL:GLYCEROL V15:2-AMINO-6-(2-PHENYLETHYL)PYRIMIDIN-4(3H)-ONE | |||
2v0z | [A] | [A] | [A] | 2.2 | C41:ALISKIREN NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
2v10 | [A] | [A] | [A] | 3.1 | C61:(2R,4S,5S,7S)-5-AMINO-N-BUTYL-4-HYDROXY-7-[4-METHOXY-3-(3-METHOXYPROPOXY)BENZYL]-2,8-DIMETHYLNONANAMIDE | |||
2v11 | [A] | [A] | [A] | 3.1 | C80:(2S,4S,5R,7R)-4-AMINO-8-(BUTYLAMINO)-5-HYDROXY-2,7-DIMETHYL-8-OXOOCTYL 1-BENZYL-1H-INDOLE-3-CARBOXYLATE | |||
2v12 | [A2] | [A2] | [A2] | 3.2 | C39:N-[(2S,4S,5S,7R)-4-AMINO-8-(BUTYLAMINO)-5-HYDROXY-7-METHYL-2-(1-METHYLETHYL)-8-OXOOCTYL]-2-(3-METHOXYPROPOXY)BENZAMIDE | |||
2v13 | [A] | [A] | [A] | 2.8 | C40:N-[(2R,4S,5S,7R)-4-AMINO-8-(BUTYLAMINO)-5-HYDROXY-2,7-DIMETHYL-8-OXOOCTYL]-2-(3-METHOXYPROPOXY)BENZAMIDE | |||
2v16 | [A6] | [A6] | [A6] | 2.8 | C47:METHYL (3R)-1-[(5S,6S,8R)-5-AMINO-9-BUTYLAMINO-6-HYDROXY-3,3,8-TRIMETHYL-9-OXO-NONANOYL]-3,4-DIHYDRO-2H-QUINOLINE-3-CARBOXYLATE | |||
2va5 | [A2] | [A2] | [A2] | 2.75 | C8C:2-AMINO-6-[2-(1H-INDOL-6-YL)ETHYL]PYRIMIDIN-4(3H)-ONE IOD:IODIDE ION | |||
2va6 | [A2] | [A2] | [A2] | 2.5 | H24:(6S)-2-AMINO-6-(3___sq___-METHOXYBIPHENYL-3-YL)-3,6-DIMETHYL-5,6-DIHYDROPYRIMIDIN-4(3H)-ONE IOD:IODIDE ION | |||
2va7 | [A2] | [A2] | [A2] | 2.2 | C27:(6R)-2-AMINO-6-[2-(3___sq___-METHOXYBIPHENYL-3-YL)ETHYL]-3,6-DIMETHYL-5,6-DIHYDROPYRIMIDIN-4(3H)-ONE IOD:IODIDE ION | |||
2vie | [A] | [A] | [A] | 1.9 | VG0:N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(1,1,5-TRIMETHYLHEXYL)AMINO]PROPYL}-3-(ETHYLAMINO)-5-(2-OXOPYRROLIDIN-1-YL)BENZAMIDE | |||
2vij | [A] | [A] | [A] | 1.6 | C44:N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(1S)-1,2,3,4-TETRAHYDRONAPHTHALEN-1-YLAMINO]PROPYL}-3-(1,1-DIOXIDO-1,2-THIAZINAN-2-YL)-5-(ETHYLAMINO)BENZAMIDE | |||
2viy | [A] | [A] | [A] | 1.82 | VG3:N-[(1S,2R)-1-BENZYL-3-{[(1S)-2-(CYCLOHEXYLAMINO)-1-METHYL-2-OXOETHYL]AMINO}-2-HYDROXYPROPYL]-3-(PENTYLSULFONYL)BENZAMIDE | |||
2viz | [A] | [A] | [A] | 1.6 | VG4:N-[(1S,2R)-1-BENZYL-3-{[(1S)-2-(CYCLOHEXYLAMINO)-1-METHYL-2-OXOETHYL]AMINO}-2-HYDROXYPROPYL]-3-(2-OXO-2,3-DIHYDRO-1H-PYRROL-1-YL)-5-PROPOXYBENZAMIDE | |||
2vj6 | [A] | [A] | [A] | 1.8 | VG5:N-[(1S,2R)-1-BENZYL-3-{[(1S)-2-(CYCLOHEXYLAMINO)-1-METHYL-2-OXOETHYL]AMINO}-2-HYDROXYPROPYL]-3-(ETHYLAMINO)-5-(2-OXOPYRROLIDIN-1-YL)BENZAMIDE | |||
2vj7 | [A] | [A] | [A] | 1.6 | VG6:N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{[3-(TRIFLUOROMETHYL)BENZYL]AMINO}PROPYL]-3-(ETHYLAMINO)-5-(2-OXOPYRROLIDIN-1-YL)BENZAMIDE | |||
2vj9 | [A] | [A] | [A] | 1.6 | VG7:N-[(1S,2R)-1-BENZYL-3-(CYCLOHEXYLAMINO)-2-HYDROXYPROPYL]-3-(ETHYLAMINO)-5-(2-OXOPYRROLIDIN-1-YL)BENZAMIDE | |||
2vkm | [A] | [A] | [A] | 2.05 | BSD:N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-5-[METHYL(METHYLSULFONYL)AMINO]-N___sq___-[(1R)-1-PHENYLETHYL]BENZENE-1,3-DICARBOXAMIDE | |||
2vnm | [A] | [A] | [A] | 1.79 | CM8:N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{[3-(TRIFLUOROMETHYL)BENZYL]AMINO}PROPYL]-3-(1,1-DIOXIDO-1,2-THIAZINAN-2-YL)-5-(ETHYLAMINO)BENZAMIDE | |||
2vnn | [A] | [A] | [A] | 1.87 | CM7:N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{[3-(TRIFLUOROMETHYL)BENZYL]AMINO}PROPYL]-7-ETHYL-1-METHYL-3,4-DIHYDRO-1H-[1,2,5]THIADIAZEPINO[3,4,5-HI]INDOLE-9-CARBOXAMIDE 2,2-DIOXIDE | |||
2vs2 | [A] | [A] | [A] | 2 | 0QS:N~2~-[(2R)-2-BENZYL-3-(TERT-BUTYLSULFONYL)PROPANOYL]-N-{(1R)-1-(CYCLOHEXYLMETHYL)-3,3-DIFLUORO-2,2-DIHYDROXY-4-[(2-MORPHOLIN-4-YLETHYL)AMINO]-4-OXOBUTYL}-3-(1H-IMIDAZOL-3-IUM-4-YL)-L-ALANINAMIDE SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
2wea | [A2] | [A2] | [A2] | 1.25 | MAN:ALPHA-D-MANNOPYRANOSE PP6:METHYL[CYCLO-7[(2R)-((N-VALYL)AMINO)-2-(HYDROXYL-(1S)-1-METHYLOXYCARBONYL-2-PHENYLETHOXY)PHOSPHINYLOXY-ETHYL]-1-NAPHTHALENEACETAMIDE] SO4:SULFATE ION | |||
2web | [A2] | [A2] | [A2] | 1.5 | MAN:ALPHA-D-MANNOPYRANOSE PP4:METHYL (2S)-[1-((N-FORMYL)-L-VALYL)AMINO-2-(2-NAPHTHYL)ETHYL)HYDROXYPHOSPHINYLOXY]-3-PHENYLPROPANOATE SO4:SULFATE ION | |||
2wec | [A2] | [A2] | [A2] | 1.5 | MAN:ALPHA-D-MANNOPYRANOSE PP5:METHYL (2S)-[1-((N-(NAPHTHALENEACETYL))-L-VALYL)AMINOMETHYL)HYDROXYPHOSPHINYLOXY]-3-PHENYL PROPANOATE SO4:SULFATE ION | |||
2wed | [A2] | [A2] | [A2] | 1.5 | MAN:ALPHA-D-MANNOPYRANOSE PP6:METHYL[CYCLO-7[(2R)-((N-VALYL)AMINO)-2-(HYDROXYL-(1S)-1-METHYLOXYCARBONYL-2-PHENYLETHOXY)PHOSPHINYLOXY-ETHYL]-1-NAPHTHALENEACETAMIDE] SO4:SULFATE ION | |||
2wez | [A] | [A] | [A] | 1.7 | ZYE:N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-1-ETHYL-4-(2-OXOPYRROLIDIN-1-YL)-1H-INDOLE-6-CARBOXAMIDE | |||
2wf0 | [A] | [A] | [A] | 1.6 | ZY0:N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{[3-(TRIFLUOROMETHYL)BENZYL]AMINO}PROPYL]-4-ETHYL-8-(2-OXOPYRROLIDIN-1-YL)QUINOLINE-6-CARBOXAMIDE | |||
2wf1 | [A] | [A] | [A] | 1.6 | ZY1:N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-7-ETHYL-1-METHYL-3,4-DIHYDRO-1H-[1,2,5]THIADIAZEPINO[3,4,5-HI]INDOLE-9-CARBOXAMIDE 2,2-DIOXIDE | |||
2wf2 | [A] | [A] | [A] | 1.8 | ZY2:N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-8-ETHYL-1-METHYL-3,4,7,8-TETRAHYDRO-1H,6H-[1,2,5]THIADIAZEPINO[5,4,3-DE]QUINOXALINE-10-CARBOXAMIDE 2,2-DIOXIDE | |||
2wf3 | [A] | [A] | [A] | 2.08 | GOL:GLYCEROL ZY3:N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-6-(ETHYLAMINO)-1-METHYL-1,3,4,5-TETRAHYDRO-2,1-BENZOTHIAZEPINE-8-CARBOXAMIDE 2,2-DIOXIDE | |||
2wf4 | [A] | [A] | [A] | 1.8 | ZY4:N-[(1S)-1-BENZYL-2,2-DIHYDROXY-3-(TETRAHYDRO-2H-PYRAN-4-YLAMINO)PROPYL]-6-ETHYL-1-METHYL-1,3,4,6-TETRAHYDRO[1,2]THIAZEPINO[5,4,3-CD]INDOLE-8-CARBOXAMIDE 2,2-DIOXIDE | |||
2whh | [A] | [A] | [A] | 1.69 | GLU:GLUTAMIC ACID PPN:PARA-NITROPHENYLALANINE | |||
2wjo | [A] | [A] | [A] | 2.5 | QUD:2-AMINO-3-{(1R)-1-CYCLOHEXYL-2-[(CYCLOHEXYLCARBONYL)AMINO]ETHYL}-6-PHENOXYQUINAZOLIN-3-IUM | |||
2wkz | [A2] | [A2] | [A2] | 1.7 | 5AH:METHYL [(1S)-1-({2-[(3S)-3-BENZYL-3-HYDROXY-4-{[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]AMINO}-4-OXOBUTYL]-2-(4-PYRIDIN-2-YLBENZYL)HYDRAZINO}CARBONYL)-2,2-DIMETHYLPROPYL]CARBAMATE | |||
2wl0 | [A2] | [A2] | [A2] | 1.9 | 5AH:METHYL [(1S)-1-({2-[(3S)-3-BENZYL-3-HYDROXY-4-{[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]AMINO}-4-OXOBUTYL]-2-(4-PYRIDIN-2-YLBENZYL)HYDRAZINO}CARBONYL)-2,2-DIMETHYLPROPYL]CARBAMATE | |||
2xfi | [A] | [A] | [A] | 1.73 | XFI:N-((1S,2R)-3-(((1S)-2-(CYCLOHEXYLAMINO)-1-METHYL-2-OXOETHYL)AMINO)-2-HYDROXY-1-( PHENYLMETHYL)PROPYL)-3-((METHYLSULFONYL)(PHENYL)AMINO) BENZAMIDE | |||
2xfj | [A] | [A] | [A] | 1.8 | VG5:N-[(1S,2R)-1-BENZYL-3-{[(1S)-2-(CYCLOHEXYLAMINO)-1-METHYL-2-OXOETHYL]AMINO}-2-HYDROXYPROPYL]-3-(ETHYLAMINO)-5-(2-OXOPYRROLIDIN-1-YL)BENZAMIDE | |||
2xfk | [A] | [A] | [A] | 1.8 | AA9:N-((1S,2R)-3-(((1S)-2-(CYCLOHEXYLAMINO)-1--METHYL-2-OXOETHYL)AMINO)-2-HYDROXY-1-(PHENYLMETHYL)PROPYL)-3-(ETHYLAMINO)-5-((METHYLSULFONYL)(PHENYL)AMINO)BENZAMIDE | |||
2xye | [A2] | [A2] | [A2] | 2 | CXG:METHYL N-[(2S)-1-[2-[(4R)-5-[[(2S)-3,3-DIMETHYL-1-METHYLAMINO-1-OXO-BUTAN-2-YL]AMINO]-4-HYDROXY-5-OXO-4-(PHENYLMETHYL)PENTYL]-2-[(4-PHENYLPHENYL)METHYL]HYDRAZINYL]-3,3-DIMETHYL-1-OXO-BUTAN-2-YL]CARBAMATE | |||
2xyf | [A2] | [A2] | [A2] | 1.8 | G40:METHYL N-[(2S)-1-[2-[(4R)-5-[[(2S)-3,3-DIMETHYL-1-METHYLAMINO-1-OXO-BUTAN-2-YL]AMINO]-4-HYDROXY-5-OXO-4-(PHENYLMETHYL)PENTYL]-2-[(4-THIOPHEN-3-YLPHENYL)METHYL]HYDRAZINYL]-3,3-DIMETHYL-1-OXO-BUTAN-2-YL]CARBAMATE | |||
2z4o | [A2] | [A2] | [A2] | 1.6 | 065:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(2S,3R)-3-HYDROXY-4-(N-ISOBUTYLBENZO[D][1,3]DIOXOLE-5-SULFONAMIDO)-1-PHENYLBUTAN-2-YLCARBAMATE ACT:ACETATE ION CL:CHLORIDE ION NA:SODIUM ION | |||
2z54 | [A2] | [A2] | [A2] | 2.31 | AB1:N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE BME:BETA-MERCAPTOETHANOL | |||
2zdz | [A] | [A] | [A] | 2 | 310:N-CARBAMIMIDOYL-2-[2-(2-CHLOROPHENYL)-5-[4-(4-ETHANOYLPHENOXY)PHENYL]PYRROL-1-YL]ETHANAMIDE | |||
2ze1 | [A] | [A] | [A] | 2.2 | 411:3-BROMO-N-[4-[1-(2-CARBAMIMIDAMIDO-2-OXO-ETHYL)-5-PHENYL-PYRROL-2-YL]PHENYL]BENZAMIDE | |||
2zga | [A2] | [A2] | [A2] | 1.65 | YDP:(3S,4S),-3,4-BIS-[(4-CARBAMOYL-BENZENSULFONYL)-(3-METHYL-BUT-2-ENYL)-AMINO]-PYRROLIDINE | |||
2zhr | [A][a] | [A][a] | [A][a] | 2.5 | 1OL:(2R,4S,5S)-5-AMINO-4-HYDROXY-2,7-DIMETHYLOCTANOIC ACID | |||
2zhs | [A] | [A] | [A] | 2.7 | ||||
2zht | [A] | [A] | [A] | 2.35 | ||||
2zhu | [A] | [A] | [A] | 2.4 | ||||
2zhv | [A] | [A] | [A] | 1.85 | ||||
2zjh | [A] | [A] | [A] | 2.6 | F1H:N-(1-BENZYLPIPERIDIN-4-YL)-4-SULFANYLBUTANAMIDE | |||
2zji | [A] | [A] | [A] | 2.3 | F1I:N-[1-(2,6-DIMETHOXYBENZYL)PIPERIDIN-4-YL]-4-SULFANYLBUTANAMIDE | |||
2zjj | [A] | [A] | [A] | 2.2 | F1J:(2S)-4-(4-FLUOROBENZYL)-N-(2-SULFANYLETHYL)PIPERAZINE-2-CARBOXAMIDE | |||
2zjk | [A] | [A] | [A] | 3 | F1K:(2S)-4-(4-FLUOROBENZYL)-N-(3-SULFANYLPROPYL)PIPERAZINE-2-CARBOXAMIDE | |||
2zjl | [A] | [A] | [A] | 2.1 | F1L:N-[1-(5-BROMO-2,3-DIMETHOXYBENZYL)PIPERIDIN-4-YL]-4-SULFANYLBUTANAMIDE | |||
2zjm | [A] | [A] | [A] | 1.9 | F1M:N-{1-[5-CHLORO-3-METHOXY-2-(1-METHYLETHOXY)BENZYL]PIPERIDIN-4-YL}-2-(4-SULFAMOYLPHENOXY)ACETAMIDE | |||
2zjn | [A] | [A] | [A] | 2.7 | F1N:N-{1-[5-CHLORO-3-METHOXY-2-(1-METHYLETHOXY)BENZYL]PIPERIDIN-4-YL}-2-(2-METHYL-4-SULFAMOYLPHENOXY)ACETAMIDE | |||
2zye | [A2] | [A2] | [A2] | 1.9 | KNI:(4R)-N-TERT-BUTYL-3-[(2S,3S)-2-HYDROXY-3-({N-[(ISOQUINOLIN-5-YLOXY)ACETYL]-S-METHYL-L-CYSTEINYL}AMINO)-4-PHENYLBUTANOYL]-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
3a2o | [A2] | [A2] | [A2] | 0.88 | GOL:GLYCEROL KNJ:(4R)-3-[(2S,3S)-3-{[(4-AMINO-2,6-DIMETHYLPHENOXY)ACETYL]AMINO}-2-HYDROXY-4-PHENYLBUTANOYL]-5,5-DIMETHYL-N-(2-METHYLPROP -2-EN-1-YL)-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
3aid | [A2] | [A2] | [A2] | 2.5 | ARQ:BENZOYLAMINO-BENZYL-METHYL-[2-HYDROXY-3-[1-METHYL-ETHYL-OXY-N-FORMAMIDYL]-4-PHENYL-BUTYL]-AMMONIUM | |||
3app | [A] | [A] | [A] | 1.8 | ||||
3apr | [A][a] | [A][a] | [A][a] | 1.8 | PUK:N-[(2S)-2-AMINO-3-PHENYLPROPYL]-L-PHENYLALANINE | |||
3aup | [A4] | [A4] | [A4] | 1.91 | ||||
3b7v | [A2][a] | [A2][a] | [A2][a] | 1.46 | CL:CHLORIDE ION GOL:GLYCEROL LNT:N-[(2S)-2-AMINO-1,1-DIHYDROXY-4-METHYLPENTYL]-L-THREONINE NA:SODIUM ION | |||
3b80 | [A2][a] | [A2][a] | [A2][a] | 1.5 | CL:CHLORIDE ION LNT:N-[(2S)-2-AMINO-1,1-DIHYDROXY-4-METHYLPENTYL]-L-THREONINE NA:SODIUM ION | |||
3bc4 | [A2] | [A2] | [A2] | 1.82 | DMS:DIMETHYL SULFOXIDE LLG:2-AMINOETHYL NAPHTHALEN-1-YLACETATE | |||
3bgb | [A2] | [A2] | [A2] | 1.9 | CL:CHLORIDE ION LJG:N,N___sq___-(IMINODIETHANE-2,1-DIYL)BIS[4-AMINO-N-(2-METHYLPROPYL)BENZENESULFONAMIDE] | |||
3bgc | [A2] | [A2] | [A2] | 1.8 | CL:CHLORIDE ION LJH:N,N___sq___-(IMINODIETHANE-2,1-DIYL)BIS(4-AMINO-N-BENZYLBENZENESULFONAMIDE) | |||
3bhe | [A2] | [A2] | [A2] | 1.75 | BZN:N-({(3R,4R)-4-[(BENZYLOXY)METHYL]PYRROLIDIN-3-YL}METHYL)-N-(2-METHYLPROPYL)BENZENESULFONAMIDE | |||
3bra | [A] | [A] | [A] | 2.3 | AEF:4-(2-AMINOETHYL)PHENOL | |||
3buf | [A] | [A] | [A] | 2.3 | AEG:4-[(2R)-2-AMINOPROPYL]PHENOL | |||
3bug | [A] | [A] | [A] | 2.5 | AEH:4-(2-AMINOETHYL)-2-ETHYLPHENOL | |||
3buh | [A] | [A] | [A] | 2.3 | AED:4-(2-AMINOETHYL)-2-CYCLOHEXYLPHENOL | |||
3bva | [A2] | [A2] | [A2] | 1.05 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE GOL:GLYCEROL | |||
3bvb | [A2] | [A2] | [A2] | 1.3 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
3bxr | [A2] | [A2] | [A2] | 1.6 | ABA:ALPHA-AMINOBUTYRIC ACID DRR:(9S,12S)-9-(1-METHYLETHYL)-N-[(8S,11S)-8-[(1S)-1-METHYLPROPYL]-7,10-DIOXO-2-OXA-6,9-DIAZABICYCLO[11.2.2]HEPTADECA-1(15),13,16-TRIEN-11-YL]-7,10-DIOXO-2-OXA-8,11-DIAZABICYCLO[12.2.2]OCTADECA-1(16),14,17-TRIENE-12-CARBOXAMIDE SO4:SULFATE ION | |||
3bxs | [A2] | [A2] | [A2] | 1.6 | ABA:ALPHA-AMINOBUTYRIC ACID DRS:(9S,12S)-9-(1-METHYLETHYL)-7,10-DIOXO-2-OXA-8,11-DIAZABICYCLO[12.2.2]OCTADECA-1(16),14,17-TRIENE-12-CARBOXYLIC ACID SO4:SULFATE ION | |||
3c9x | [A] | [A] | [A] | 1.7 | GOL:GLYCEROL PCA:PYROGLUTAMIC ACID | |||
3cib | [A] | [A] | [A] | 1.72 | 314:N___sq___-[(1S,2R)-2-[(2R,4S)-4-BENZYLPIPERIDIN-2-YL]-1-(3,5-DIFLUOROBENZYL)-2-HYDROXYETHYL]-5-METHYL-N,N-DIPROPYLBENZENE-1,3-DICARBOXAMIDE TAR:D(-)-TARTARIC ACID | |||
3cic | [A] | [A] | [A] | 1.75 | 316:N___sq___-[(1S,2S)-2-[(2S)-4-BENZYL-3-OXOPIPERAZIN-2-YL]-1-(3,5-DIFLUOROBENZYL)-2-HYDROXYETHYL]-5-METHYL-N,N-DIPROPYLBENZENE-1,3-DICARBOXAMIDE TAR:D(-)-TARTARIC ACID | |||
3cid | [A] | [A] | [A] | 1.8 | 318:N___sq___-[(1S,2S)-2-[(4S)-1-BENZYL-5-OXOIMIDAZOLIDIN-4-YL]-1-(3,5-DIFLUOROBENZYL)-2-HYDROXYETHYL]-5-METHYL-N,N-DIPROPYLBENZENE-1,3-DICARBOXAMIDE TAR:D(-)-TARTARIC ACID | |||
3ckp | [A] | [A] | [A] | 2.3 | 012:(4S)-N-[(1S,2R)-1-BENZYL-3-{[3-(DIMETHYLAMINO)BENZYL]AMINO}-2-HYDROXYPROPYL]-1-(3-METHOXYBENZYL)-2-OXOIMIDAZOLIDINE-4-CARBOXAMIDE CL:CHLORIDE ION | |||
3ckr | [A] | [A] | [A] | 2.7 | 009:(4S)-1,4-DIBENZYL-N-[(1S,2R)-1-BENZYL-3-{[3-(DIMETHYLAMINO)BENZYL]AMINO}-2-HYDROXYPROPYL]-2-OXOIMIDAZOLIDINE-4-CARBOXAMIDE | |||
3ckt | [A2] | [A2] | [A2] | 1.65 | CL:CHLORIDE ION YDP:(3S,4S),-3,4-BIS-[(4-CARBAMOYL-BENZENSULFONYL)-(3-METHYL-BUT-2-ENYL)-AMINO]-PYRROLIDINE | |||
3cms | [A] | [A] | [A] | 2 | ||||
3cyw | [A2] | [A2] | [A2] | 1.4 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION GOL:GLYCEROL | |||
3cyx | [A2] | [A2] | [A2] | 1.2 | ACY:ACETIC ACID GOL:GLYCEROL NA:SODIUM ION PO4:PHOSPHATE ION ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1 -PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3d1x | [A2] | [A2] | [A2] | 1.05 | CL:CHLORIDE ION GOL:GLYCEROL ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1 -PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3d1y | [A2] | [A2] | [A2] | 1.05 | CL:CHLORIDE ION NA:SODIUM ION ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1 -PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3d1z | [A2] | [A2] | [A2] | 1.3 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACY:ACETIC ACID CL:CHLORIDE ION | |||
3d20 | [A2] | [A2] | [A2] | 1.05 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION NA:SODIUM ION | |||
3d3t | [A2][a] | [A2][a] | [A2][a] | 2.8 | ||||
3d91 | [A] | [A] | [A] | 2.2 | DMS:DIMETHYL SULFOXIDE REM:NALPHA-[(2S)-2-BENZYL-3-(TERT-BUTYLSULFONYL)PROPANOYL]-N-[(1S,2R,3S)-1-(CYCLOHEXYLMETHYL)-3-CYCLOPROPYL-2,3-DIHYDROXYPROPYL]-L-HISTIDINAMIDE | |||
3dck | [A2] | [A2] | [A2] | 1.8 | ABA:ALPHA-AMINOBUTYRIC ACID KVI:(2S)-2-{[(2R,5S)-5-{[(2S,3S)-2-{[(2S,3R)-2-(ACETYLAMINO)-3-HYDROXYBUTANOYL]AMINO}-3-METHYLPENTANOYL]AMINO}-2-BUTYL-4-OXONONANOYL]AMINO}-N~1~-[(2S)-1-AMINO-5-CARBAMIMIDAMIDO-1-OXOPENTAN-2-YL]PENTANEDIAMIDE NLE:NORLEUCINE YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3dcr | [A2] | [A2] | [A2] | 1.4 | ABA:ALPHA-AMINOBUTYRIC ACID KVS:N~2~-[(2R,5S)-5-({(2S,3S)-2-[(N-ACETYL-L-THREONYL)AMINO]-3-METHYLPENT-4-ENOYL}AMINO)-2-BUTYL-4,4-DIHYDROXYNONANOYL]-L-GLUTAMINYL-L-ARGININAMIDE NLE:NORLEUCINE YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3djk | [A2] | [A2] | [A2] | 1 | CL:CHLORIDE ION G55:(5R)-1,3-DIOXEPAN-5-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}PROPYL]CARBAMATE NA:SODIUM ION | |||
3dk1 | [A2] | [A2] | [A2] | 1.07 | CL:CHLORIDE ION G05:(4AR,6R,7AS)-HEXAHYDRO-4AH-CYCLOPENTA[B][1,4]DIOXIN-6-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}PROPYL]CARBAMATE NA:SODIUM ION | |||
3dm6 | [A] | [A] | [A] | 2.6 | 757:5-[[(2S)-2-[[(3R,4S)-5-(3,5-DIFLUOROPHENOXY)-3-HYDROXY-4-[[3-(METHYL-METHYLSULFONYL-AMINO)-5-[[(1R)-1-PHENYLETHYL]CARBAMOYL]PHENYL]CARBONYLAMINO]PENTANOYL]AMINO]-3-METHYL-BUTANOYL]AMINO]BENZENE-1,3-DICARBOXYLIC ACID IPA:ISOPROPYL ALCOHOL | |||
3dox | [A][ab] | [A][ab] | [A][ab] | 2 | ||||
3duy | [A] | [A] | [A] | 1.97 | AFJ:(2R,4S,5S)-N-BUTYL-4-HYDROXY-2,7-DIMETHYL-5-{[N-(4-METHYLPENTANOYL)-L-METHIONYL]AMINO}OCTANAMIDE | |||
3dv1 | [A] | [A] | [A] | 2.1 | AR9:(2R,4S)-N-BUTYL-4-[(2S,5S,7R)-2,7-DIMETHYL-3,15-DIOXO-1,4-DIAZACYCLOPENTADECAN-5-YL]-4-HYDROXY-2-METHYLBUTANAMIDE | |||
3dv5 | [A] | [A] | [A] | 2.1 | BAV:(3S,14R,16S)-16-[(1R)-1-HYDROXY-2-{[3-(1-METHYLETHYL)BENZYL]AMINO}ETHYL]-3,4,14-TRIMETHYL-1,4-DIAZACYCLOHEXADECANE-2,5-DIONE | |||
3ebz | [A2] | [A2] | [A2] | 1.2 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION IMD:IMIDAZOLE NA:SODIUM ION ZN:ZINC ION | |||
3ec0 | [A2] | [A2] | [A2] | 1.18 | CL:CHLORIDE ION GRL:(3AS,5R,6AR)-HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL (2S,3S)-3-HYDROXY-4-(4-(HYDROXYMETHYL)-N-ISOBUTYLPHENYLSULFONAMIDO)-1-PHENYLBUTAN-2-YLCARBAMATE IMD:IMIDAZOLE NA:SODIUM ION ZN:ZINC ION | |||
3ecg | [A2] | [A2] | [A2] | 1.18 | 065:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(2S,3R)-3-HYDROXY-4-(N-ISOBUTYLBENZO[D][1,3]DIOXOLE-5-SULFONAMIDO)-1-PHENYLBUTAN-2-YLCARBAMATE CL:CHLORIDE ION IMD:IMIDAZOLE NA:SODIUM ION ZN:ZINC ION | |||
3ekp | [A2] | [A2] | [A2] | 2.15 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER ACT:ACETATE ION PO4:PHOSPHATE ION | |||
3ekq | [A2] | [A2] | [A2] | 2.2 | PO4:PHOSPHATE ION ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1 -PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3ekt | [A2] | [A2] | [A2] | 1.97 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION PO4:PHOSPHATE ION | |||
3ekv | [A2] | [A2] | [A2] | 1.75 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER ACT:ACETATE ION | |||
3ekw | [A2] | [A2] | [A2] | 1.6 | DR7:(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5, 6,10,13-PENTAAZATETRADECANEDIOICACID DIMETHYL ESTER PO4:PHOSPHATE ION | |||
3ekx | [A2] | [A2] | [A2] | 1.97 | 1UN:2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL SULFANYL-BUTYL]-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID TERT-BUTYLAMIDE ACT:ACETATE ION | |||
3eky | [A2] | [A2] | [A2] | 1.8 | DR7:(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5, 6,10,13-PENTAAZATETRADECANEDIOICACID DIMETHYL ESTER PO4:PHOSPHATE ION | |||
3el0 | [A2] | [A2] | [A2] | 2 | 1UN:2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL SULFANYL-BUTYL]-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID TERT-BUTYLAMIDE ACT:ACETATE ION PO4:PHOSPHATE ION | |||
3el1 | [A2] | [A2] | [A2] | 1.7 | ACT:ACETATE ION DR7:(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5, 6,10,13-PENTAAZATETRADECANEDIOICACID DIMETHYL ESTER | |||
3el4 | [A2] | [A2] | [A2] | 2 | ACT:ACETATE ION ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1 -PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3el5 | [A2] | [A2] | [A2] | 1.6 | 1UN:2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL SULFANYL-BUTYL]-DECAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID TERT-BUTYLAMIDE ACT:ACETATE ION | |||
3el9 | [A2] | [A2] | [A2] | 1.6 | ACT:ACETATE ION DR7:(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5, 6,10,13-PENTAAZATETRADECANEDIOICACID DIMETHYL ESTER PO4:PHOSPHATE ION | |||
3em3 | [A2] | [A2] | [A2] | 2.2 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER ACT:ACETATE ION | |||
3em4 | [A2] | [A2] | [A2] | 2.1 | DR7:(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5, 6,10,13-PENTAAZATETRADECANEDIOICACID DIMETHYL ESTER PO4:PHOSPHATE ION | |||
3em6 | [A2] | [A2] | [A2] | 2.1 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION PO4:PHOSPHATE ION | |||
3emy | [A][a] | [A][a] | [A][a] | 1.85 | IVA:ISOVALERIC ACID PCA:PYROGLUTAMIC ACID STA:STATINE | |||
3er3 | [A] | [A] | [A] | 2 | 0EL:6-AMMONIO-N-[(2R,4R,5R)-5-{[N-(TERT-BUTOXYCARBONYL)-L-PHENYLALANYL-3-(1H-IMIDAZOL-3-IUM-4-YL)-L-ALANYL]AMINO}-6-CYCLOHEXYL-4-HYDROXY-2-(2-METHYLPROPYL)HEXANOYL]-L-NORLEUCYLPHENYLALANINE | |||
3er5 | [A][a] | [A][a] | [A][a] | 1.8 | STA:STATINE | |||
3exo | [A] | [A] | [A] | 2.1 | 5MS:N-{2-METHYL-5-[(6-PHENYLPYRIMIDIN-4-YL)AMINO]PHENYL}METHANESULFONAMIDE GOL:GLYCEROL SO4:SULFATE ION | |||
3f9q | [A2] | [A2] | [A2] | 1.9 | ||||
3fiv | [A2][a2] | [A2][a2] | [A2][a2] | 1.85 | ACE:ACETYL GROUP ALN:NAPHTHALEN-2-YL-3-ALANINE CSD:3-SULFINOALANINE NH2:AMINO GROUP SO4:SULFATE ION | |||
3fkt | [A2] | [A2] | [A2] | 1.9 | SII:N-(4-{[4-(CYCLOHEXYLAMINO)-1-(3-FLUOROPHENYL)-2-OXO-1,3,8-TRIAZASPIRO[4.5]DEC-3-EN-8-YL]METHYL}PHENYL)ACETAMIDE | |||
3fns | [A2] | [A2] | [A2] | 2.5 | ZN:ZINC ION | |||
3fnt | [A2][a2] | [A2][a2] | [A2][a2] | 3.3 | EDO:1,2-ETHANEDIOL IVA:ISOVALERIC ACID STA:STATINE | |||
3fnu | [A2] | [A2] | [A2] | 3 | 006:(4R)-3-[(2S,3S)-3-{[(2,6-DIMETHYLPHENOXY)ACETYL]AMINO}-2-HYDROXY-4-PHENYLBUTANOYL]-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
3fsm | [A] | [A] | [A] | 1.6 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID DAL:D-ALANINE NLE:NORLEUCINE YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3fv3 | [A][a] | [A][a] | [A][a] | 1.85 | GOL:GLYCEROL IVA:ISOVALERIC ACID SO4:SULFATE ION STA:STATINE | |||
3fx5 | [A2] | [A2] | [A2] | 0.93 | GOL:GLYCEROL KNI:(4R)-N-TERT-BUTYL-3-[(2S,3S)-2-HYDROXY-3-({N-[(ISOQUINOLIN-5-YLOXY)ACETYL]-S-METHYL-L-CYSTEINYL}AMINO)-4-PHENYLBUTANOYL]-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
3g6z | [A] | [A] | [A] | 2 | A7T:(1R,5S)-N-CYCLOPROPYL-7-{4-[2-(2,6-DICHLORO-4-METHYLPHENOXY)ETHOXY]PHENYL}-N-(2,3-DIMETHYLBENZYL)-3,9-DIAZABICYCLO[3.3.1]NON-6-ENE-6-CARBOXAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
3g70 | [A] | [A] | [A] | 2 | A5T:(1R,5S)-7-{4-[3-(2-CHLORO-3,6-DIFLUOROPHENOXY)PROPYL]PHENYL}-N-CYCLOPROPYL-N-(2,3-DICHLOROBENZYL)-3,9-DIAZABICYCLO[3.3.1]NON-6-ENE-6-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
3g72 | [A] | [A] | [A] | 1.9 | A6T:(1S,5R)-7-{4-[3-(2-CHLORO-3,6-DIFLUOROPHENOXY)PROPYL]PHENYL}-N-CYCLOPROPYL-N-(2,3-DICHLOROBENZYL)-3,9-DIAZABICYCLO[3.3.1]NON-6-ENE-6-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
3gga | [A2] | [A2] | [A2] | 2.5 | GGW:METHYL [(1S,4S,5S,7S,10S)-4-BENZYL-1,10-DI-TERT-BUTYL-5-HYDROXY-2,9,12-TRIOXO-7-(4-PYRIDIN-2-YLBENZYL)-13-OXA-3,8,11-TRIAZATETRADEC-1-YL]CARBAMATE | |||
3ggu | [A2] | [A2] | [A2] | 1.8 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
3ggv | [A2] | [A2] | [A2] | 3.09 | GGV:METHYL [(1S)-1-{[(1R,3S,4S)-3-HYDROXY-4-{[(2S)-2-(3-{[6-(1-HYDROXY-1-METHYLETHYL)PYRIDIN-2-YL]METHYL}-2-OXO-2,3-DIHYDRO-1H-IMIDAZOL-1-YL)-3,3-DIMETHYLBUTANOYL]AMINO}-5-PHENYL-1-(4-PYRIDIN-2-YLBENZYL)PENTYL]CARBAMOYL}-2,2-DIMETHYLPROPYL]CARBAMATE | |||
3ggx | [A2] | [A2] | [A2] | 2.7 | GGX:METHYL [(1S)-1-{[(1R,3S,4S)-4-{[(2S)-3,3-DIMETHYL-2-{3-[(6-METHYLPYRIDIN-2-YL)METHYL]-2-OXO-2,3-DIHYDRO-1H-IMIDAZOL-1-YL}BUTANOYL]AMINO}-3-HYDROXY-5-PHENYL-1-(4-PYRIDIN-2-YLBENZYL)PENTYL]CARBAMOYL}-2,2-DIMETHYLPROPYL]CARBAMATE | |||
3gi0 | [A2][a2] | [A2][a2] | [A2][a2] | 1.8 | ABA:ALPHA-AMINOBUTYRIC ACID ACE:ACETYL GROUP DAL:D-ALANINE JG3:1-[(2S,3S)-3-AMINO-2-HYDROXY-4-PHENYLBUTYL]-L-PROLINE NLE:NORLEUCINE VME:METHYL L-VALINATE YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3gi4 | [A2] | [A2] | [A2] | 1.85 | ACT:ACETATE ION K60:5S)-N-[(1S,2R)-3-[(1,3-BENZODIOXOL-5-YLSULFONYL)(2-METHYLPROPYL)AMINO]-2-HYDROXY-1-(PHENYLMETHYL)PROPYL]-2-OXO-3-[3-(TR IFLUOROMETHYL)PHENYL]-5-OXAZOLIDINECARBOXAMIDE PO4:PHOSPHATE ION | |||
3gi5 | [A2] | [A2] | [A2] | 1.8 | K62:(5S)-3-(3-ACETYLPHENYL)-N-[(1S,2R)-3-[(1,3-BENZODIOXOL-5-YLSULFONYL)(2-METHYLPROPYL)AMINO]-2-HYDROXY-1-(PHENYLMETHYL)PR OPYL]-2-OXO-5-OXAZOLIDINECARBOXAMIDE PO4:PHOSPHATE ION | |||
3gi6 | [A2] | [A2] | [A2] | 1.84 | D78:(5S)-N-[(1S,2R)-2-HYDROXY-3-[[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO]-1-(PHENYLMETHYL)PROPYL]-2-OXO-3-[3-(TRIF LUOROMETHYL)PHENYL]-5-OXAZOLIDINECARBOXAMIDE PO4:PHOSPHATE ION | |||
3gw5 | [A] | [A] | [A] | 2 | 72X:(3R)-3-[(1S)-1-(3-CHLOROPHENYL)-1-HYDROXY-5-METHOXYPENTYL]-N-{(1S)-2-CYCLOHEXYL-1-[(METHYLAMINO)METHYL]ETHYL}PIPERIDINE-1-CARBOXAMIDE CL:CHLORIDE ION GOL:GLYCEROL NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
3h0b | [A] | [A] | [A] | 2.7 | B35:4-[(1S)-1-(3-FLUORO-4-METHOXYPHENYL)-2-(2-METHOXY-5-NITROPHENYL)ETHYL]-1H-IMIDAZOL-2-AMINE | |||
3h5b | [A2] | [A2] | [A2] | 1.29 | 031:(3AS,5R,6AR)-HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-([(4-METHOXYPHENYL)SULFONYL]{[(2R)-5-OXOPYRROLIDIN-2-YL]METHYL}AMINO)PROPYL]CARBAMATE CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
3hau | [A] | [A] | [A] | 1.3 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID NLE:NORLEUCINE SMC:S-METHYLCYSTEINE SO4:SULFATE ION | |||
3haw | [A] | [A] | [A] | 1.3 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID NLE:NORLEUCINE SMC:S-METHYLCYSTEINE SO4:SULFATE ION | |||
3hbo | [A] | [A] | [A] | 1.71 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID DAL:D-ALANINE NLE:NORLEUCINE SMC:S-METHYLCYSTEINE | |||
3hd8 | [AB] | [AB] | [AB] | 2.39 | ||||
3hdk | [A] | [A] | [A] | 1.8 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID AIB:ALPHA-AMINOISOBUTYRIC ACID NLE:NORLEUCINE SMC:S-METHYLCYSTEINE | |||
3hlo | [A] | [A] | [A] | 1.6 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID DAL:D-ALANINE NLE:NORLEUCINE YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3hvg | [A] | [A] | [A] | 2.26 | EV0:2-AMINO-6-PROPYLPYRIMIDIN-4(3H)-ONE GOL:GLYCEROL | |||
3hvp | [A2] | [A2] | [A2] | 2.8 | ABA:ALPHA-AMINOBUTYRIC ACID | |||
3hw1 | [A] | [A] | [A] | 2.48 | EV2:3-PYRROLIDIN-1-YLQUINOXALIN-2-AMINE GOL:GLYCEROL | |||
3hzc | [A] | [A] | [A] | 1.45 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID AIB:ALPHA-AMINOISOBUTYRIC ACID NLE:NORLEUCINE YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3i25 | [A] | [A] | [A] | 2.1 | MV7:N-[(2S,3S,5R)-1-(3,5-DIFLUOROPHENOXY)-3-HYDROXY-5-(2-METHOXYETHOXY)-6-[[(2S)-3-METHYL-1-OXO-1-(PHENYLMETHYLAMINO)BUTAN-2-YL]AMINO]-6-OXO-HEXAN-2-YL]-5-(METHYL-METHYLSULFONYL-AMINO)-N___sq___-[(1R)-1-PHENYLETHYL]BENZENE-1,3-DICARBOXAMIDE | |||
3i2l | [A] | [A] | [A] | 1.5 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID IIL:ISO-ISOLEUCINE NLE:NORLEUCINE YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3i6o | [A2] | [A2] | [A2] | 1.17 | GOL:GLYCEROL GR6:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL {(1S,2R)-1-BENZYL-2-HYDROXY-3-[(7E)-13-METHOXY-1,1-DIOXIDO-3,4,5,6,9,10-HEXAHYDRO-2H-11,1,2-BENZOXATHIAZACYCLOTRIDECIN-2-YL]PROPYL}CARBAMATE IOD:IODIDE ION NA:SODIUM ION | |||
3i7e | [A2] | [A2] | [A2] | 1.7 | DJR:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}PROPYL]CARBAMATE | |||
3i8w | [A2] | [A2] | [A2] | 1.7 | CB5:COBALT BIS(1,2-DICARBOLLIDE) CL:CHLORIDE ION GOL:GLYCEROL | |||
3ia9 | [A] | [A] | [A] | 1.3 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID NLE:NORLEUCINE SO4:SULFATE ION YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3iaw | [A] | [A] | [A] | 1.61 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID AIB:ALPHA-AMINOISOBUTYRIC ACID NLE:NORLEUCINE SO4:SULFATE ION YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3igb | [A] | [A] | [A] | 2.24 | 454:8,8-DIPHENYL-2,3,4,8-TETRAHYDROIMIDAZO[1,5-A]PYRIMIDIN-6-AMINE | |||
3in3 | [A] | [A] | [A] | 2 | 472:(5S)-2-AMINO-3-METHYL-5-PYRIDIN-4-YL-5-(3-PYRIDIN-3-YLPHENYL)-3,5-DIHYDRO-4H-IMIDAZOL-4-ONE | |||
3in4 | [A] | [A] | [A] | 2.3 | BX2:(5S)-2-AMINO-5-(2,6-DIETHYLPYRIDIN-4-YL)-3-METHYL-5-(3-PYRIMIDIN-5-YLPHENYL)-3,5-DIHYDRO-4H-IMIDAZOL-4-ONE | |||
3ind | [A] | [A] | [A] | 2.25 | 593:(5S)-2-AMINO-3-METHYL-5-PHENYL-5-[(3S,5S,7S)-TRICYCLO[3.3.1.1~3,7~]DEC-1-YL]-3,5-DIHYDRO-4H-IMIDAZOL-4-ONE | |||
3ine | [A] | [A] | [A] | 2 | X17:(5S)-2-AMINO-5-(4-METHOXY-3-METHYLPHENYL)-3-METHYL-5-[(3S,5S,7S)-TRICYCLO[3.3.1.1~3,7~]DEC-1-YL]-3,5-DIHYDRO-4H-IMIDAZOL-4-ONE | |||
3inf | [A] | [A] | [A] | 1.85 | X45:(5S)-2-AMINO-5-(4-METHOXY-3-METHYLPHENYL)-3-METHYL-5-(3-PYRIDIN-3-YLPHENYL)-3,5-DIHYDRO-4H-IMIDAZOL-4-ONE | |||
3inh | [A] | [A] | [A] | 1.8 | 569:(5R)-2-AMINO-5-(4-FLUORO-3-PYRIMIDIN-5-YLPHENYL)-3-METHYL-5-[4-(TRIFLUOROMETHOXY)PHENYL]-3,5-DIHYDRO-4H-IMIDAZOL-4-ONE | |||
3ivh | [A] | [A] | [A] | 1.8 | 1LI:N-[(1S,2R)-3-{[1-(3-TERT-BUTYLPHENYL)CYCLOHEXYL]AMINO}-1-(3,5-DIFLUOROBENZYL)-2-HYDROXYPROPYL]ACETAMIDE | |||
3ivi | [A] | [A] | [A] | 2.2 | 2LI:N-[(1S,2R)-3-{[(5S)-5-(3-TERT-BUTYLPHENYL)-4,5,6,7-TETRAHYDRO-1H-INDAZOL-5-YL]AMINO}-1-(3,5-DIFLUOROBENZYL)-2-HYDROXYPROPYL]ACETAMIDE GOL:GLYCEROL SO4:SULFATE ION | |||
3ixj | [A] | [A] | [A] | 2.2 | 586:N-[4-(1-BENZYLCARBAMOYL-2-METHYL-PROPYLCARBAMOYL)-1-(3,5-DIFLUORO-PHENOXYMETHYL)-2-HYDROXY-4-METHOXY-BUTYL]-5-(METHANESULFONYL-METHYL-AMINO)-N___sq___-(1-PHENYLETHYL)-ISOPHTHALAMIDE SO4:SULFATE ION | |||
3ixk | [A] | [A] | [A] | 2.5 | 929:N-[(2S,3S,5R)-1-[(3,5-DIFLUOROPHENYL)METHOXY]-3-HYDROXY-5-METHYL-6-[[(2S)-3-METHYL-1-OXO-1-(PHENYLMETHYLAMINO)BUTAN-2-YL]AMINO]-6-OXO-HEXAN-2-YL]-5-(METHYL-METHYLSULFONYL-AMINO)-N___sq___-[(1R)-1-PHENYLETHYL]BENZENE-1,3-DICARBOXAMIDE | |||
3ixo | [A2] | [A2] | [A2] | 1.7 | ||||
3jvw | [A2] | [A2] | [A2] | 1.8 | DMP:[4-R-(-4-ALPHA,5-ALPHA,6-BETA,7-BETA)]-HEXAHYDRO-5,6-BIS(HYDROXY)-[1,3-BIS([4-HYDROXYMETHYL-PHENYL]METHYL)-4,7-BIS(PHEN YLMETHYL)]-2H-1,3-DIAZEPINONE | |||
3jvy | [A2] | [A2] | [A2] | 1.6 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION NA:SODIUM ION | |||
3jw2 | [A2] | [A2] | [A2] | 1.8 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION NA:SODIUM ION | |||
3k1w | [A] | [A] | [A] | 1.5 | BFX:4-{4-[3-(2-BROMO-5-FLUOROPHENOXY)PROPYL]PHENYL}-N-(2-CHLOROBENZYL)-N-CYCLOPROPYL-1,2,5,6-TETRAHYDROPYRIDINE-3-CARBOXAMIDE CL:CHLORIDE ION FMT:FORMIC ACID HSQ:2-ACETYLAMINO-2-DEOXY-ALPHA-L-IDOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
3k4v | [A2] | [A2] | [A2] | 1.39 | ARF:FORMAMIDE CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1 -PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3k5c | [A] | [A] | [A] | 2.12 | 0BI:(4S)-4-[(1R)-1-HYDROXY-2-({1-[3-(1-METHYLETHYL)PHENYL]CYCLOPROPYL}AMINO)ETHYL]-19-(METHOXYMETHYL)-11-OXA-3,16-DIAZATRICYCLO[15.3.1.1~6,10~]DOCOSA-1(21),6(22),7,9,17,19-HEXAEN-2-ONE | |||
3k5d | [A] | [A] | [A] | 2.9 | XLI:N-ACETYL-L-LEUCYL-N-[(4S,5S,7R)-8-(BUTYLAMINO)-5-HYDROXY-2,7-DIMETHYL-8-OXOOCTAN-4-YL]-L-METHIONINAMIDE | |||
3k5f | [A] | [A] | [A] | 2.25 | AYH:(1R,3S)-3-[1-(ACETYLAMINO)-1-METHYLETHYL]-N-[(1S,2S,4R)-1-BENZYL-5-(BUTYLAMINO)-2-HYDROXY-4-METHYL-5-OXOPENTYL]CYCLOHEXANECARBOXAMIDE | |||
3k5g | [A] | [A] | [A] | 2 | BJC:(1R,3S)-N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-{[3-(1-METHYLETHYL)BENZYL]AMINO}PROPYL]-3-[1-METHYL-1-(2-OXOPIPERIDIN-1-YL)ETHYL]CYCLOHEXANECARBOXAMIDE | |||
3ka2 | [A] | [A] | [A] | 1.4 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID NLE:NORLEUCINE YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3kdb | [A2] | [A2] | [A2] | 1.66 | 006:(4R)-3-[(2S,3S)-3-{[(2,6-DIMETHYLPHENOXY)ACETYL]AMINO}-2-HYDROXY-4-PHENYLBUTANOYL]-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE GOL:GLYCEROL | |||
3kdc | [A2] | [A2] | [A2] | 2.2 | CL:CHLORIDE ION GOL:GLYCEROL JZP:(4R)-3-[(2S,3S)-3-{[(2,6-DICHLOROPHENOXY)ACETYL]AMINO}-2-HYDROXY-4-PHENYLBUTANOYL]-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
3kdd | [A2] | [A2] | [A2] | 1.8 | GOL:GLYCEROL JZQ:(4R)-3-[(2S,3S)-3-{[(2,6-DIFLUOROPHENOXY)ACETYL]AMINO}-2-HYDROXY-4-PHENYLBUTANOYL]-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H- INDEN-1-YL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
3kf0 | [A2] | [A2] | [A2] | 1.8 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE 4DX:(1S,2S)-2-METHYLCYCLOHEXANOL BME:BETA-MERCAPTOETHANOL DMS:DIMETHYL SULFOXIDE K:POTASSIUM ION | |||
3kfn | [A2] | [A2] | [A2] | 1.77 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE 4DX:(1S,2S)-2-METHYLCYCLOHEXANOL BME:BETA-MERCAPTOETHANOL DMS:DIMETHYL SULFOXIDE K:POTASSIUM ION | |||
3kfp | [A2] | [A2] | [A2] | 1.77 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE BME:BETA-MERCAPTOETHANOL DMS:DIMETHYL SULFOXIDE | |||
3kfr | [A2] | [A2] | [A2] | 1.3 | 1F1:1H-INDOLE-6-CARBOXYLIC ACID 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE BME:BETA-MERCAPTOETHANOL | |||
3kfs | [A2] | [A2] | [A2] | 1.8 | 2FX:1-BENZOTHIOPHEN-2-YLACETIC ACID 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE BME:BETA-MERCAPTOETHANOL DMS:DIMETHYL SULFOXIDE | |||
3km4 | [A2] | [A2] | [A2] | 1.9 | 22X:(3R)-3-[(1S)-4-(ACETYLAMINO)-1-(3-CHLOROPHENYL)-1-HYDROXYBUTYL]-N-{(1S)-2-CYCLOHEXYL-1-[(METHYLAMINO)METHYL]ETHYL}PIPERIDINE-1-CARBOXAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
3kmx | [A2] | [A2] | [A2] | 1.7 | G00:4-BUTOXY-3-CHLOROBENZYL IMIDOTHIOCARBAMATE | |||
3kmy | [A2] | [A2] | [A2] | 1.9 | D8Y:3-[2-(3-CHLOROPHENYL)ETHYL]PYRIDIN-2-AMINE | |||
3kn0 | [A2] | [A2] | [A2] | 1.9 | 3TO:3-[2-(3-{[(FURAN-2-YLMETHYL)(METHYL)AMINO]METHYL}PHENYL)ETHYL]PYRIDIN-2-AMINE TLA:L(+)-TARTARIC ACID | |||
3kt2 | [A] | [A] | [A] | 1.65 | ||||
3kt5 | [A] | [A] | [A] | 1.8 | ||||
3kyr | [A] | [A] | [A] | 2.6 | 038:3-[[(2S)-2-[[[(2S)-2-[[(2S)-2-[[(2S)-2-AZANYL-3-(1H-1,2,3,4-TETRAZOL-5-YLCARBONYLAMINO)PROPANOYL]AMINO]-3-METHYL-BUTANOYL]AMINO]-4-METHYL-PENTANOYL]AMINO]METHYL]-2-HYDROXY-4-PHENYL-BUTANOYL]AMINO]BENZOIC ACID | |||
3l38 | [A] | [A] | [A] | 2.1 | 879:6-({2-(2-CHLOROPHENYL)-5-[4-(PYRIMIDIN-5-YLOXY)PHENYL]-1H-PYRROL-1-YL}METHYL)PYRIDIN-2-AMINE | |||
3l3a | [A] | [A] | [A] | 2.36 | 625:4-(4-{1-[(6-AMINOPYRIDIN-2-YL)METHYL]-5-(2-CHLOROPHENYL)-1H-PYRROL-2-YL}PHENOXY)BUTANENITRILE | |||
3l58 | [A] | [A] | [A] | 1.8 | CS5:N___sq___-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE | |||
3l59 | [A] | [A] | [A] | 2 | BDJ:(2Z)-3-(3-CHLOROBENZYL)-2-IMINO-5,5-DIMETHYLIMIDAZOLIDIN-4-ONE TAR:D(-)-TARTARIC ACID | |||
3l5b | [A] | [A] | [A] | 1.8 | BDO:(2Z,5R)-3-(3-CHLOROBENZYL)-2-IMINO-5-METHYL-5-(2-METHYLPROPYL)IMIDAZOLIDIN-4-ONE TAR:D(-)-TARTARIC ACID | |||
3l5c | [A] | [A] | [A] | 1.8 | BDQ:1-(4-CYANOPHENYL)-3-(4-{[(2Z,4R)-2-IMINO-4-METHYL-4-(2-METHYLPROPYL)-5-OXOIMIDAZOLIDIN-1-YL]METHYL}BENZYL)UREA TAR:D(-)-TARTARIC ACID | |||
3l5d | [A] | [A] | [A] | 1.75 | BDV:1-BUTYL-3-(4-{[(2Z,4R)-2-IMINO-4-METHYL-4-(2-METHYLPROPYL)-5-OXOIMIDAZOLIDIN-1-YL]METHYL}BENZYL)UREA TAR:D(-)-TARTARIC ACID | |||
3l5e | [A] | [A] | [A] | 1.53 | BDW:(4S)-1-(4-{[(2Z,4R)-4-(2-CYCLOHEXYLETHYL)-4-(CYCLOHEXYLMETHYL)-2-IMINO-5-OXOIMIDAZOLIDIN-1-YL]METHYL}BENZYL)-4-PROPYLIMIDAZOLIDIN-2-ONE TAR:D(-)-TARTARIC ACID | |||
3l5f | [A] | [A] | [A] | 1.7 | BDX:(2E,5R)-5-(2-CYCLOHEXYLETHYL)-5-(CYCLOHEXYLMETHYL)-2-IMINO-3-METHYLIMIDAZOLIDIN-4-ONE TAR:D(-)-TARTARIC ACID | |||
3lhg | [A] | [A] | [A] | 2.1 | Z81:(5S)-2-AMINO-5-(2___sq___,5___sq___-DIFLUOROBIPHENYL-3-YL)-3-METHYL-5-PYRIDIN-4-YL-3,5-DIHYDRO-4H-IMIDAZOL-4-ONE | |||
3lin | [A2] | [A2] | [A2] | 1.96 | E13:N-[(2S,3S)-4-{(4R)-4-[(2,2-DIMETHYLPROPYL)CARBAMOYL]-5,5-DIMETHYL-1,3-THIAZOLIDIN-3-YL}-3-HYDROXY-4-OXO-1-PHENYLBUTAN-2-YL]-N~2~-{(2S)-2-[(METHOXYCARBONYL)AMINO]-2-PHENYLACETYL}-3-METHYL-L-VALINAMIDE | |||
3liq | [A2] | [A2] | [A2] | 2.29 | E14:(4R)-3-[(2S,3S)-3-[[(2S)-2-[[(2S)-2-AZANYL-2-PHENYL-ETHANOYL]AMINO]-3,3-DIMETHYL-BUTANOYL]AMINO]-2-HYDROXY-4-PHENYL-BUT ANOYL]-5,5-DIMETHYL-N-(2-METHYLPROPYL)-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
3lit | [A2] | [A2] | [A2] | 2.19 | E15:(4R)-3-[(2S,3S)-3-[[(2S)-2-[[(2S)-2-AZANYL-2-PHENYL-ETHANOYL]AMINO]-3,3-DIMETHYL-BUTANOYL]AMINO]-2-HYDROXY-4-PHENYL-BUT ANOYL]-5,5-DIMETHYL-N-[(2R)-3-METHYLBUTAN-2-YL]-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
3liv | [A2] | [A2] | [A2] | 2.59 | E16:(4R)-3-[(2S,3S)-3-[[(2S)-2-[[(2S)-2-AZANYL-2-PHENYL-ETHANOYL]AMINO]-3,3-DIMETHYL-BUTANOYL]AMINO]-2-HYDROXY-4-PHENYL-BUT ANOYL]-N-[(2R)-3,3-DIMETHYLBUTAN-2-YL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE | |||
3lix | [A2] | [A2] | [A2] | 2.7 | E17:N-{(1S,2S)-1-BENZYL-3-[(4R)-5,5-DIMETHYL-4-{[(1R)-1,2,2-TRIMETHYLPROPYL]CARBAMOYL}-1,3-THIAZOLIDIN-3-YL]-2-HYDROXY-3-OXOPROPYL}-3-METHYL-N~2~-{(2S)-2-[(MORPHOLIN-4-YLACETYL)AMINO]-2-PHENYLACETYL}-L-VALINAMIDE ZN:ZINC ION | |||
3liy | [A2][a] | [A2][a] | [A2][a] | 1.86 | PEG:DI(HYDROXYETHYL)ETHER STA:STATINE | |||
3liz | [ABC] | [ABC] | [A2B] | 1.8 | BMA:BETA-D-MANNOPYRANOSE CD:CADMIUM ION EDO:1,2-ETHANEDIOL MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE ZN:ZINC ION | |||
3lnk | [A] | [A] | [A] | 1.8 | 74A:N___sq___-{(1S,2S)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-2-[(2R)-4-(PHENYLCARBONYL)PIPERAZIN-2-YL]ETHYL}-5-METHYL-N,N-DIPROPYLBENZENE-1,3-DICARBOXAMIDE TLA:L(+)-TARTARIC ACID | |||
3lpi | [A2] | [A2] | [A2] | 2.05 | TLA:L(+)-TARTARIC ACID Z74:N___sq___-{(1S,2S)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-2-[(2R)-4-(PHENYLSULFONYL)PIPERAZIN-2-YL]ETHYL}-5-METHYL-N,N-DIPROPYLBENZENE-1,3-DICARBOXAMIDE | |||
3lpj | [A2] | [A2] | [A2] | 1.79 | TLA:L(+)-TARTARIC ACID Z75:N___sq___-[(1S,2S)-2-[(2R)-4-BENZYLPIPERAZIN-2-YL]-1-(3,5-DIFLUOROBENZYL)-2-HYDROXYETHYL]-5-METHYL-N,N-DIPROPYLBENZENE-1,3-DICARBOXAMIDE | |||
3lpk | [A2] | [A2] | [A2] | 1.93 | TLA:L(+)-TARTARIC ACID Z76:N-[(1S,2S)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-2-{(2R)-4-[(3-METHYLPHENYL)SULFONYL]PIPERAZIN-2-YL}ETHYL]-3-{[(2R)-2-(METHOXYMETHYL)PYRROLIDIN-1-YL]CARBONYL}-5-METHYLBENZAMIDE | |||
3lzs | [A2] | [A2] | [A2] | 1.95 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION | |||
3lzu | [A2] | [A2] | [A2] | 1.76 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION | |||
3lzv | [A2] | [A2] | [A2] | 2.15 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION PO4:PHOSPHATE ION | |||
3lzy | [A] | [A] | [A] | 1.8 | GOL:GLYCEROL XE:XENON | |||
3m9f | [A2] | [A2] | [A2] | 1.8 | 595:N-[(1S,5S)-5-{[(4-AMINOPHENYL)SULFONYL](3-METHYLBUTYL)AMINO}-1-METHYL-6-OXOHEXYL]-NALPHA-(METHOXYCARBONYL)-BETA-PHENYL-L-PHENYLALANINAMIDE CL:CHLORIDE ION | |||
3msj | [A] | [A] | [A] | 1.8 | EV3:3-(2-AMINO-5-CHLORO-1H-BENZIMIDAZOL-1-YL)PROPAN-1-OL GOL:GLYCEROL | |||
3msk | [A] | [A] | [A] | 2 | EV4:4-(2-AMINO-5-CHLORO-1H-BENZIMIDAZOL-1-YL)-N-CYCLOHEXYL-N-METHYLBUTANAMIDE GOL:GLYCEROL IOD:IODIDE ION | |||
3msl | [A] | [A] | [A] | 2.4 | EV5:(3S)-3-(2-AMINO-5-CHLORO-1H-BENZIMIDAZOL-1-YL)-N-(CYCLOHEXYLMETHYL)PENTANAMIDE IOD:IODIDE ION | |||
3mws | [A2] | [A2] | [A2] | 1.09 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION | |||
3mxd | [A2] | [A2] | [A2] | 1.95 | ACT:ACETATE ION K53:(5S)-N-{(1S,2R)-3-[(1,3-BENZODIOXOL-5-YLSULFONYL)(2-METHYLPROPYL)AMINO]-1-BENZYL-2-HYDROXYPROPYL}-3-(2-HYDROXYPHENYL)-2 -OXO-1,3-OXAZOLIDINE-5-CARBOXAMIDE PO4:PHOSPHATE ION | |||
3mxe | [A2] | [A2] | [A2] | 1.85 | ACT:ACETATE ION K54:(5S)-N-{(1S,2R)-3-[(1,3-BENZOTHIAZOL-6-YLSULFONYL)(2-METHYLPROPYL)AMINO]-1-BENZYL-2-HYDROXYPROPYL}-2-OXO-3-[2-(TRIFLUOROMETHYL)PHENYL]-1,3-OXAZOLIDINE-5-CARBOXAMIDE PO4:PHOSPHATE ION | |||
3n3i | [A] | [A] | [A] | 2.5 | ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3n4l | [A] | [A] | [A] | 2.7 | 842:N-[(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-3-({1-[3-(1H-PYRAZOL-1-YL)PHENYL]CYCLOHEXYL}AMINO)PROPYL]ACETAMIDE | |||
3ndt | [A2] | [A2] | [A2] | 1.72 | ARF:FORMAMIDE CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE NA:SODIUM ION ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3ndu | [A2] | [A2] | [A2] | 1.25 | ACT:ACETATE ION ARF:FORMAMIDE CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL NA:SODIUM ION ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3ndw | [A2] | [A2] | [A2] | 1.14 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE NA:SODIUM ION RIT:RITONAVIR SO4:SULFATE ION | |||
3ndx | [A2] | [A2] | [A2] | 1.03 | CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL RIT:RITONAVIR SO4:SULFATE ION | |||
3nls | [A2] | [A2] | [A2] | 1.7 | 016:(4R)-3-[(2R,3S)-3-{[(2,6-DIMETHYLPHENOXY)ACETYL]AMINO}-2-HYDROXY-4-PHENYLBUTANOYL]-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL URE:UREA | |||
3nr6 | [A2] | [A2] | [A2] | 1.97 | K:POTASSIUM ION PO4:PHOSPHATE ION | |||
3nsh | [A] | [A] | [A] | 2.2 | 957:N-[(1S,2R)-1-(3,5-DIFLUOROBENZYL)-3-({1-[4-(2,2-DIMETHYLPROPYL)THIOPHEN-2-YL]CYCLOPROPYL}AMINO)-2-HYDROXYPROPYL]ACETAMIDE | |||
3nu3 | [A2] | [A2] | [A2] | 1.02 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
3nu4 | [A2] | [A2] | [A2] | 1.2 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER CL:CHLORIDE ION NA:SODIUM ION | |||
3nu5 | [A2] | [A2] | [A2] | 1.29 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER ACT:ACETATE ION CL:CHLORIDE ION NA:SODIUM ION | |||
3nu6 | [A2] | [A2] | [A2] | 1.16 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER ACT:ACETATE ION CL:CHLORIDE ION NA:SODIUM ION | |||
3nu9 | [A2] | [A2] | [A2] | 1.85 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER IOD:IODIDE ION | |||
3nuj | [A2] | [A2] | [A2] | 1.5 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER IOD:IODIDE ION | |||
3nuo | [A2] | [A2] | [A2] | 1.35 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER IOD:IODIDE ION | |||
3nwq | [A2] | [A2] | [A2] | 1.5 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID NLE:NORLEUCINE OIL:(2S,3S)-2-HYDROXY-3-METHYLPENTANOIC ACID YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3nwx | [A2] | [A2] | [A2] | 1.9 | ABA:ALPHA-AMINOBUTYRIC ACID KVS:N~2~-[(2R,5S)-5-({(2S,3S)-2-[(N-ACETYL-L-THREONYL)AMINO]-3-METHYLPENT-4-ENOYL}AMINO)-2-BUTYL-4,4-DIHYDROXYNONANOYL]-L-GLUTAMINYL-L-ARGININAMIDE NLE:NORLEUCINE OIL:(2S,3S)-2-HYDROXY-3-METHYLPENTANOIC ACID SO4:SULFATE ION YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3nxe | [A] | [A] | [A] | 1.61 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID NLE:NORLEUCINE OIL:(2S,3S)-2-HYDROXY-3-METHYLPENTANOIC ACID SO4:SULFATE ION YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3nxn | [A] | [A] | [A] | 1.8 | ABA:ALPHA-AMINOBUTYRIC ACID KVS:N~2~-[(2R,5S)-5-({(2S,3S)-2-[(N-ACETYL-L-THREONYL)AMINO]-3-METHYLPENT-4-ENOYL}AMINO)-2-BUTYL-4,4-DIHYDROXYNONANOYL]-L-GLUTAMINYL-L-ARGININAMIDE NLE:NORLEUCINE OIL:(2S,3S)-2-HYDROXY-3-METHYLPENTANOIC ACID SO4:SULFATE ION YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3nyg | [A2] | [A2] | [A2] | 1.45 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID GOA:GLYCOLIC ACID NLE:NORLEUCINE SO4:SULFATE ION YCM:S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | |||
3o99 | [A2] | [A2] | [A2] | 1.95 | ACT:ACETATE ION K13:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-{[(4-AMINOPHENYL)SULFONYL][(2S)-2-METHYLBUTYL]AMINO}-1-BENZYL-2-HYDROXYPROPYL]CARBAMATE PO4:PHOSPHATE ION | |||
3o9a | [A2] | [A2] | [A2] | 1.9 | K14:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL][(2S)-2-METHYLBUTYL]AMINO}PROPYL]CARBAMATE PO4:PHOSPHATE ION | |||
3o9b | [A2] | [A2] | [A2] | 1.5 | ACT:ACETATE ION GOL:GLYCEROL K2A:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-({[4-(HYDROXYMETHYL)PHENYL]SULFONYL}[(2S)-2-METHYLBUTYL]AMINO)PROPYL]CARBAMATE PO4:PHOSPHATE ION | |||
3o9c | [A2] | [A2] | [A2] | 1.85 | K20:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-{(1,3-BENZODIOXOL-5-YLSULFONYL)[(2S)-2-METHYLBUTYL]AMINO}-1-BENZYL-2-HYDROXYPROPYL]CARBAMATE | |||
3o9d | [A2] | [A2] | [A2] | 1.85 | ACT:ACETATE ION K19:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-{(1,3-BENZOTHIAZOL-6-YLSULFONYL)[(2S)-2-METHYLBUTYL]AMINO}-1-BENZYL-2-HYDROXYPROPYL]CARBAMATE PO4:PHOSPHATE ION | |||
3o9e | [A2] | [A2] | [A2] | 1.5 | A60:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-{[(4-AMINOPHENYL)SULFONYL](2-ETHYLBUTYL)AMINO}-1-BENZYL-2-HYDROXYPROPYL]CARBAMATE ACT:ACETATE ION PO4:PHOSPHATE ION | |||
3o9f | [A2] | [A2] | [A2] | 1.7 | ACT:ACETATE ION K2D:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-1-BENZYL-3-{(2-ETHYLBUTYL)[(4-METHOXYPHENYL)SULFONYL]AMINO}-2-HYDROXYPROPYL]CARBAMATE PO4:PHOSPHATE ION | |||
3o9g | [A2] | [A2] | [A2] | 1.65 | F53:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL {(1S,2R)-1-BENZYL-3-[(2-ETHYLBUTYL){[4-(HYDROXYMETHYL)PHENYL]SULFONYL}AMINO]-2-HYDROXYPROPYL}CARBAMATE PO4:PHOSPHATE ION | |||
3o9h | [A2] | [A2] | [A2] | 1.7 | ACT:ACETATE ION K2E:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL {(1S,2R)-3-[(1,3-BENZODIOXOL-5-YLSULFONYL)(2-ETHYLBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYL}CARBAMATE PO4:PHOSPHATE ION | |||
3o9i | [A2] | [A2] | [A2] | 1.45 | A61:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL {(1S,2R)-3-[(1,3-BENZOTHIAZOL-6-YLSULFONYL)(2-ETHYLBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYL}CARBAMATE PO4:PHOSPHATE ION | |||
3o9l | [AB] | [AB] | [A2] | 2.4 | LPN:(3R,4S)-N-[2-CHLORO-5-(3-METHOXYPROPYL)BENZYL]-N-CYCLOPROPYL-4-{4-[2-(2,6-DICHLORO-4-METHYLPHENOXY)ETHOXY]PHENYL}PIPERIDINE-3-CARBOXAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
3oad | [AB] | [AB] | [A2] | 2.17 | LPO:(3S,4R)-N-[2-CHLORO-5-(2-METHOXYETHYL)BENZYL]-N-CYCLOPROPYL-4-{6-[2-(2,6-DICHLORO-4-METHYLPHENOXY)ETHOXY]PYRIDIN-3-YL}-4-HYDROXYPIPERIDINE-3-CARBOXAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
3oag | [AB] | [AB] | [A2] | 2.3 | LPQ:(3R,4S)-N-{2-CHLORO-5-[(CYCLOPROPYLAMINO)METHYL]BENZYL}-N-CYCLOPROPYL-4-{6-[2-(2,6-DICHLORO-4-METHYLPHENOXY)ETHOXY]PYRIDIN-3-YL}PIPERIDINE-3-CARBOXAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
3ogp | [A2] | [A2] | [A2] | 1.7 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE DMS:DIMETHYL SULFOXIDE | |||
3ogq | [A2] | [A2] | [A2] | 1.8 | AB1:N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE DMS:DIMETHYL SULFOXIDE | |||
3ohf | [A2] | [A2] | [A2] | 2.1 | 3HF:N~3~-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-N~1~,N~1~-DIBUTYL-1H-INDOLE-1,3-DICARBOXAMIDE GOL:GLYCEROL IOD:IODIDE ION | |||
3ohh | [A2] | [A2] | [A2] | 2.01 | 3HH:N~1~-BUTYL-5-CYANO-N~3~-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-N~1~-METHYL-1H-INDOLE-1,3-DICARBOXAMIDE GOL:GLYCEROL SO4:SULFATE ION | |||
3ok9 | [A2] | [A2] | [A2] | 1.27 | CL:CHLORIDE ION G52:(3R,3AS,3BR,6AS,7AS)-OCTAHYDRODIFURO[2,3-B:3___sq___,2___sq___-D]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}PROPYL]CARBAMATE GOL:GLYCEROL NA:SODIUM ION | |||
3oot | [A] | [A] | [A] | 2.55 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SSR:2-(3-FLUORO-2-METHYLBENZYL)-4-METHYL-1-PHENYL-3-(PIPERAZIN-1-YLCARBONYL)-1H-INDOL-5-OL | |||
3ooz | [A] | [A] | [A] | 1.8 | ZOO:(5R)-2-AMINO-5-[4-(DIFLUOROMETHOXY)PHENYL]-5-[4-FLUORO-3-(5-FLUOROPENT-1-YN-1-YL)PHENYL]-3-METHYL-3,5-DIHYDRO-4H-IMIDAZOL-4-ONE | |||
3oq7 | [A2] | [A2] | [A2] | 1.71 | ||||
3oqa | [A2] | [A2] | [A2] | 2.25 | ||||
3oqd | [A2] | [A2] | [A2] | 1.71 | ||||
3oqf | [A] | [A] | [A] | 2.78 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE S51:2-BENZYL-1-PHENYL-3-(PIPERAZIN-1-YLCARBONYL)-1H-INDOLE | |||
3oqk | [A] | [A] | [A] | 2.9 | GOL:GLYCEROL NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE S52:2-PHENOXY-1-PHENYL-3-(PIPERAZIN-1-YLCARBONYL)-1H-INDOLE | |||
3ots | [A2][a] | [A2][a] | [A2][a] | 1.7 | ||||
3oty | [A2][a] | [A2][a] | [A2][a] | 1.75 | ||||
3ou1 | [AB][a] | [A2][a] | [A2][a] | 1.8 | ||||
3ou3 | [A2][a] | [A2][a] | [A2][a] | 1.7 | ||||
3ou4 | [AB][a] | [A2][a] | [A2][a] | 1.6 | ||||
3oua | [A2][a] | [A2][a] | [A2][a] | 1.7 | ||||
3oub | [A2][a] | [A2][a] | [A2][a] | 1.6 | ||||
3ouc | [A2][a] | [A2][a] | [A2][a] | 2 | ||||
3oud | [AB][a] | [A2][a] | [A2][a] | 1.8 | ||||
3own | [A] | [A] | [A] | 2 | 3OW:(2S,4S)-4-HYDROXY-2-(1-METHYLETHYL)-4-[(4S,13S)-18-[METHYL(METHYLSULFONYL)AMINO]-2,15-DIOXO-4-PHENYL-11-OXA-3,14-DIAZATRICYCLO[14.3.1.1~5,9~]HENICOSA-1(20),5(21),6,8,16,18-HEXAEN-13-YL]-N-(2-METHYLPROPYL)BUTANAMIDE 3OX:(2S,4S)-4-HYDROXY-2-(1-METHYLETHYL)-4-[(4R,13S)-18-[METHYL(METHYLSULFONYL)AMINO]-2,15-DIOXO-4-PHENYL-11-OXA-3,14-DIAZATRICYCLO[14.3.1.1~5,9~]HENICOSA-1(20),5(21),6,8,16,18-HEXAEN-13-YL]-N-(2-METHYLPROPYL)BUTANAMIDE ACT:ACETATE ION NA:SODIUM ION | |||
3oxc | [A2] | [A2] | [A2] | 1.16 | FMT:FORMIC ACID ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE SO4:SULFATE ION | |||
3oxv | [A2] | [A2] | [A2] | 1.75 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER ACT:ACETATE ION GOL:GLYCEROL PO4:PHOSPHATE ION SO4:SULFATE ION | |||
3oxw | [A2] | [A2] | [A2] | 1.95 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION EDO:1,2-ETHANEDIOL GOL:GLYCEROL PO4:PHOSPHATE ION | |||
3oxx | [A2] | [A2] | [A2] | 1.65 | ACT:ACETATE ION DR7:(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5,6,10,13-PENTAAZATETRADECANEDIOICACID DIMETHYL ESTER EDO:1,2-ETHANEDIOL GOL:GLYCEROL PO4:PHOSPHATE ION | |||
3oy4 | [A2] | [A2] | [A2] | 1.76 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION PO4:PHOSPHATE ION | |||
3pb5 | [A] | [A] | [A] | 1.9 | F63:N-METHYL-1-[5-(PYRIDIN-3-YLOXY)FURAN-2-YL]METHANAMINE GOL:GLYCEROL | |||
3pbd | [A] | [A] | [A] | 1.7 | F05:1H-ISOINDOL-3-AMINE GOL:GLYCEROL | |||
3pbz | [A] | [A] | [A] | 1.48 | DMS:DIMETHYL SULFOXIDE F02:4-(DIETHYLAMINO)BENZOHYDRAZIDE GOL:GLYCEROL | |||
3pcw | [A] | [A] | [A] | 1.25 | DMS:DIMETHYL SULFOXIDE FBF:4-(TRIFLUOROMETHYL)BENZENECARBOXIMIDAMIDE GOL:GLYCEROL | |||
3pcz | [A] | [A] | [A] | 1.5 | BEN:BENZAMIDINE DMS:DIMETHYL SULFOXIDE | |||
3pep | [A] | [A] | [A] | 2.3 | EOH:ETHANOL | |||
3pgi | [A] | [A] | [A] | 1.9 | F41:N-(1,3-BENZODIOXOL-5-YL)-2-(PIPERIDIN-1-YL)ACETAMIDE GOL:GLYCEROL | |||
3phv | [A2] | [A2] | [A2] | 2.7 | ||||
3pi0 | [A] | [A] | [A] | 1.64 | DMS:DIMETHYL SULFOXIDE F91:N-(PYRIDIN-4-YLMETHYL)-2,3-DIHYDRO-1,4-BENZODIOXIN-6-AMINE GOL:GLYCEROL | |||
3pi5 | [A] | [A] | [A] | 2.4 | 3P5:(3S,4S,5R)-3-(3-BROMO-4-HYDROXYBENZYL)-5-[(3-CYCLOPROPYLBENZYL)AMINO]TETRAHYDRO-2H-THIOPYRAN-4-OL1,1-DIOXIDE | |||
3pj6 | [A2] | [A2] | [A2] | 2.25 | ||||
3pld | [A] | [A] | [A] | 1.4 | F90:4-CHLOROBENZYL CARBAMIMIDOTHIOATE GOL:GLYCEROL | |||
3pll | [A] | [A] | [A] | 1.73 | F06:2-CHLOROBENZYL CARBAMIMIDOTHIOATE GOL:GLYCEROL | |||
3pm4 | [A] | [A] | [A] | 1.68 | F5N:2-(IMIDAZO[1,2-A]PYRIDIN-2-YL)-N-PHENYLACETAMIDE GOL:GLYCEROL | |||
3pmu | [A] | [A] | [A] | 1.43 | F7L:(2S)-1-[(2-FLUOROBENZYL)OXY]-3-(PYRROLIDIN-1-YL)PROPAN-2-OL | |||
3pmy | [A] | [A] | [A] | 1.38 | 41L:N-(1H-BENZIMIDAZOL-1-YL)-2-PHENYLACETAMIDE GOL:GLYCEROL | |||
3prs | [A] | [A] | [A] | 1.38 | 1PE:PENTAETHYLENE GLYCOL DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PGE:TRIETHYLENE GLYCOL RIT:RITONAVIR | |||
3psg | [A] | [A] | [A] | 1.65 | ||||
3psu | [A2] | [A2] | [A2] | 2.07 | CL:CHLORIDE ION LJG:N,N___sq___-(IMINODIETHANE-2,1-DIYL)BIS[4-AMINO-N-(2-METHYLPROPYL)BENZENESULFONAMIDE] | |||
3psy | [A] | [A] | [A] | 1.43 | 1PE:PENTAETHYLENE GLYCOL DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PG4:TETRAETHYLENE GLYCOL RB9:N-BENZYL-2-({N-[2-(1H-INDOL-3-YL)ETHYL]GLYCYL}AMINO)-4-PHENYLTHIOPHENE-3-CARBOXAMIDE | |||
3pvk | [A] | [A] | [A] | 1.27 | BEN:BENZAMIDINE IMD:IMIDAZOLE MPD:(4S)-2-METHYL-2,4-PENTANEDIOL ZN:ZINC ION | |||
3pwm | [A2] | [A2] | [A2] | 1.46 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION CL:CHLORIDE ION NA:SODIUM ION | |||
3pwr | [A2] | [A2] | [A2] | 1.45 | CL:CHLORIDE ION GOL:GLYCEROL ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3pww | [A] | [A] | [A] | 1.22 | GOL:GLYCEROL ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3q3t | [A] | [A] | [A] | 2.6 | GOL:GLYCEROL NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE RX0:[(1S,3R,4S)-3-AMINO-4-HYDROXYCYCLOPENTYL]{(3R)-3-[(1S)-1-(BIPHENYL-2-YL)-1-HYDROXY-5-METHOXYPENTYL]PIPERIDIN-1-YL}METHANONE | |||
3q4b | [A] | [A] | [A] | 2.19 | CL:CHLORIDE ION NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE RX5:METHYL (2-{(R)-(3-CHLOROPHENYL)[(3R)-1-({(2S)-2-(METHYLAMINO)-3-[(3R)-TETRAHYDRO-2H-PYRAN-3-YL]PROPYL}CARBAMOYL)PIPERIDIN-3-YL] METHOXY}ETHYL)CARBAMATE | |||
3q5h | [A] | [A] | [A] | 2.16 | CL:CHLORIDE ION NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE RX6:METHYL (2-{(R)-(3-CHLOROPHENYL)[(3R)-1-({(2S)-1-(METHYLAMINO)-3-[(3R)-TETRAHYDRO-2H-PYRAN-3-YL]PROPAN-2-YL}CARBAMOYL)PIPERIDIN-3-YL]METHOXY}ETHYL)CARBAMATE | |||
3q6y | [A] | [A] | [A] | 1.35 | 1PE:PENTAETHYLENE GLYCOL DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL S47:(3S,4S)-PYRROLIDINE-3,4-DIYL BIS(NAPHTHALEN-1-YLACETATE) | |||
3q70 | [A] | [A] | [A] | 1.4 | MRD:(4R)-2-METHYLPENTANE-2,4-DIOL RIT:RITONAVIR ZN:ZINC ION | |||
3qaa | [A2] | [A2] | [A2] | 1.4 | CL:CHLORIDE ION G04:(3R,3AS,4R,6AR)-4-METHOXYHEXAHYDROFURO[2,3-B]FURAN-3-YL[(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE GOL:GLYCEROL NA:SODIUM ION | |||
3qbf | [A2] | [A2] | [A2] | 1.45 | CL:CHLORIDE ION GOL:GLYCEROL JHG:4-{(3-PHENYLPROPYL)[(3S,4S)-4-{[4-(TRIFLUOROMETHYL)BENZYL]AMINO}PYRROLIDIN-3-YL]SULFAMOYL}BENZAMIDE | |||
3qbh | [A] | [A] | [A] | 2.24 | QBH:(4S)-4-(2-HYDROXY-5-{[(3S,4S,5R)-4-HYDROXY-1,1-DIOXIDO-5-{[3-(PROPAN-2-YL)BENZYL]AMINO}TETRAHYDRO-2H-THIOPYRAN-3-YL]METHYL}BENZYL)-3-PROPYL-1,3-OXAZOLIDIN-2-ONE | |||
3qi1 | [A] | [A] | [A] | 2.3 | C6A:N-[(2S,3R)-4-{[(2R,4S)-2-CYCLOPROPYL-6-(2,2-DIMETHYLPROPYL)-3,4-DIHYDRO-2H-CHROMEN-4-YL]AMINO}-1-(3,5-DIFLUOROPHENYL)-3-HYDROXYBUTAN-2-YL]ACETAMIDE | |||
3qih | [A2] | [A2] | [A2] | 1.39 | CL:CHLORIDE ION FG7:ETHYL 3-AMINOBENZOATE NI7:(4AS,7AS)-1,4-BIS(3-HYDROXYBENZYL)HEXAHYDRO-1H-PYRROLO[3,4-B]PYRAZINE-2,3-DIONE PGE:TRIETHYLENE GLYCOL | |||
3qn8 | [A2] | [A2] | [A2] | 1.38 | CL:CHLORIDE ION NI7:(4AS,7AS)-1,4-BIS(3-HYDROXYBENZYL)HEXAHYDRO-1H-PYRROLO[3,4-B]PYRAZINE-2,3-DIONE | |||
3qp0 | [A2] | [A2] | [A2] | 1.45 | CL:CHLORIDE ION NI8:(4AS,7AS)-1,4-BIS[3-(HYDROXYMETHYL)BENZYL]HEXAHYDRO-1H-PYRROLO[3,4-B]PYRAZINE-2,3-DIONE | |||
3qpj | [A2] | [A2] | [A2] | 1.61 | CL:CHLORIDE ION DTD:DITHIANE DIOL N4I:4-({(3S,4S)-4-[(3-HYDROXYBENZYL)AMINO]PYRROLIDIN-3-YL}[4-(TRIFLUOROMETHYL)BENZYL]SULFAMOYL)BENZAMIDE | |||
3qrm | [A2] | [A2] | [A2] | 1.73 | CL:CHLORIDE ION DTD:DITHIANE DIOL NK7:4-{[4-(TRIFLUOROMETHYL)BENZYL][(3S,4S)-4-{[4-(TRIFLUOROMETHYL)BENZYL]AMINO}PYRROLIDIN-3-YL]SULFAMOYL}BENZAMIDE | |||
3qro | [A2] | [A2] | [A2] | 1.62 | CL:CHLORIDE ION DTD:DITHIANE DIOL GOL:GLYCEROL NK9:4-({(3S,4S)-4-[(3,5-DIHYDROXYBENZYL)AMINO]PYRROLIDIN-3-YL}[4-(TRIFLUOROMETHYL)BENZYL]SULFAMOYL)BENZAMIDE | |||
3qrs | [A2] | [A2] | [A2] | 1.59 | CL:CHLORIDE ION NK8:4-({(3S,4S)-4-[(4-CARBAMOYLBENZYL)AMINO]PYRROLIDIN-3-YL}[4-(TRIFLUOROMETHYL)BENZYL]SULFAMOYL)BENZAMIDE | |||
3qrv | [A2] | [A2] | [A2] | 2.4 | ||||
3qs1 | [A4] | [A4] | [A4] | 3.1 | 006:(4R)-3-[(2S,3S)-3-{[(2,6-DIMETHYLPHENOXY)ACETYL]AMINO}-2-HYDROXY-4-PHENYLBUTANOYL]-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE GOL:GLYCEROL | |||
3qvc | [A] | [A] | [A] | 2.1 | EDO:1,2-ETHANEDIOL | |||
3qvi | [A4] | [A4] | [A4] | 2.5 | ACT:ACETATE ION EDO:1,2-ETHANEDIOL K95:(4R)-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-3-[(2S,3S)-2-HYDROXY-3-{[S-METHYL-N-(PHENYLACETYL)-L-CYSTEINYL]AMINO}-4-PHENYLBUTANOYL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE NA:SODIUM ION PG4:TETRAETHYLENE GLYCOL PG5:1-METHOXY-2-[2-(2-METHOXY-ETHOXY]-ETHANE | |||
3r0w | [A2] | [A2] | [A2] | 1.7 | RSY:N-[(2R)-1-{[(2S,3S)-5-{[(2R)-1-{[(2S)-1-AMINO-4-METHYL-1-OXOPENTAN-2-YL]AMINO}-3-CHLORO-1-OXOPROPAN-2-YL]AMINO}-3-HYDROXY-5-OXO-1-PHENYLPENTAN-2-YL]AMINO}-3-METHYL-1-OXOBUTAN-2-YL]PYRIDINE-2-CARBOXAMIDE | |||
3r0y | [A2] | [A2] | [A2] | 1.65 | RSZ:N-[(2S)-1-{[(2S,3S)-3-HYDROXY-5-OXO-5-{[(2R)-1-OXO-3-PHENYL-1-(PROP-2-YN-1-YLAMINO)PROPAN-2-YL]AMINO}-1-PHENYLPENTAN-2-YL]AMINO}-3-METHYL-1-OXOBUTAN-2-YL]PYRIDINE-2-CARBOXAMIDE | |||
3r1g | [ABC] | [ABC] | [A2B] | 2.8 | ||||
3r2f | [A] | [A] | [A] | 2.53 | PB0:(2S)-2-[(3R)-3-(ACETYLAMINO)-3-(2-METHYLPROPYL)-2-OXOPYRROLIDIN-1-YL]-N-{(1R,2S)-3-(3,5-DIFLUOROPHENYL)-1-HYDROXY-1-[(2R,4R)-4-PROPOXYPYRROLIDIN-2-YL]PROPAN-2-YL}-4-PHENYLBUTANAMIDE | |||
3r4b | [A2] | [A2] | [A2] | 1.9 | 74T:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL {(2S,3R)-4-[({2-[(1-CYCLOPENTYLPIPERIDIN-4-YL)AMINO]-1,3-BENZOTHIAZOL-6-YL}SULFONYL)(2-METHYLPROPYL)AMINO]-3-HYDROXY-1-PHENYLBUTAN-2-YL}CARBAMATE PO4:PHOSPHATE ION | |||
3rsv | [A] | [A] | [A] | 2.5 | 3RS:(2R)-3-[2-AMINO-6-(2-METHYLPHENYL)QUINOLIN-3-YL]-N-[(4R)-2,2-DIMETHYLTETRAHYDRO-2H-PYRAN-4-YL]-2-METHYLPROPANAMIDE GOL:GLYCEROL IOD:IODIDE ION | |||
3rsx | [A] | [A] | [A] | 2.48 | IOD:IODIDE ION RSV:6-(THIOPHEN-3-YL)QUINOLIN-2-AMINE | |||
3rth | [A] | [A] | [A] | 2.7 | IOD:IODIDE ION RTH:6-[2-(3,3-DIMETHYLBUT-1-YN-1-YL)PHENYL]QUINOLIN-2-AMINE | |||
3rtm | [A] | [A] | [A] | 2.76 | GOL:GLYCEROL IOD:IODIDE ION RTM:3-(2-AMINOQUINOLIN-3-YL)-N-CYCLOHEXYL-N-METHYLPROPANAMIDE | |||
3rtn | [A] | [A] | [A] | 2.7 | GOL:GLYCEROL IOD:IODIDE ION RTN:3-[2-AMINO-6-(2-METHYLPHENYL)QUINOLIN-3-YL]-N-CYCLOHEXYLPROPANAMIDE | |||
3ru1 | [A] | [A] | [A] | 2.3 | 3RU:3-(2-AMINOQUINOLIN-3-YL)-N-(CYCLOHEXYLMETHYL)PROPANAMIDE GOL:GLYCEROL IOD:IODIDE ION | |||
3rvi | [A] | [A] | [A] | 2.65 | GOL:GLYCEROL IOD:IODIDE ION RVI:(2R)-2-{[2-AMINO-6-(2-METHYLPHENYL)QUINOLIN-3-YL]METHYL}-N-(CYCLOHEXYLMETHYL)PENTANAMIDE | |||
3s2o | [A] | [A] | [A] | 2.6 | EV6:(3S)-3-(2-AMINO-5-CHLORO-1H-BENZIMIDAZOL-1-YL)-N-[(1R,3S,5R,7R)-TRICYCLO[3.3.1.1~3,7~]DEC-2-YL]PENTANAMIDE IOD:IODIDE ION | |||
3s43 | [AB] | [A2] | [A2] | 1.26 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER GOL:GLYCEROL IOD:IODIDE ION | |||
3s45 | [A2] | [A2] | [A2] | 1.51 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER CL:CHLORIDE ION IMD:IMIDAZOLE NA:SODIUM ION ZN:ZINC ION | |||
3s53 | [A2] | [A2] | [A2] | 1.5 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE IOD:IODIDE ION PO4:PHOSPHATE ION | |||
3s54 | [A2] | [A2] | [A2] | 1.42 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
3s56 | [A2] | [A2] | [A2] | 1.88 | ACT:ACETATE ION ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3s7l | [A] | [A] | [A] | 2.16 | 591:(5S)-2-AMINO-5-(1-ETHYL-1H-PYRAZOL-4-YL)-3-METHYL-5-[3-(PYRIMIDIN-5-YL)PHENYL]-3,5-DIHYDRO-4H-IMIDAZOL-4-ONE | |||
3s7m | [A] | [A] | [A] | 2.2 | 532:(5S)-2-AMINO-3-METHYL-5-[3-(PYRIDIN-3-YL)PHENYL]-5-(THIOPHEN-3-YL)-3,5-DIHYDRO-4H-IMIDAZOL-4-ONE | |||
3s85 | [A2] | [A2] | [A2] | 2.8 | LK0:METHYL N-[(2S)-1-[[(2S,3S,5S)-5-[[(2S)-2-(METHOXYCARBONYLAMINO)-3,3-DIMETHYL-BUTANOYL]AMINO]-3-OXIDANYL-6-PHENYL-1-(4-PYRIDIN-3-YLPHENYL)HEXAN-2-YL]AMINO]-3,3-DIMETHYL-1-OXIDANYLIDENE-BUTAN-2-YL]CARBAMATE | |||
3s8i | [A2] | [A2] | [A2] | 1.7 | EDO:1,2-ETHANEDIOL PEG:DI(HYDROXYETHYL)ETHER PO4:PHOSPHATE ION UNX:UNKNOWN ATOM OR ION | |||
3sa3 | [A2] | [A2] | [A2] | 1.65 | 23X:N~2~-ACETYL-N-[(2S,3R)-4-{(1,3-BENZOTHIAZOL-6-YLSULFONYL)[(2S)-2-METHYLBUTYL]AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]-L-ISOLEUCINAMIDE ACT:ACETATE ION PO4:PHOSPHATE ION | |||
3sa4 | [A2] | [A2] | [A2] | 1.8 | ACT:ACETATE ION F72:N-{(2S,3R)-4-[(1,3-BENZOTHIAZOL-6-YLSULFONYL)(CYCLOHEXYLMETHYL)AMINO]-3-HYDROXY-1-PHENYLBUTAN-2-YL}-3-HYDROXYBENZAMIDE PO4:PHOSPHATE ION | |||
3sa5 | [A2] | [A2] | [A2] | 1.65 | A69:N-{(2S,3R)-4-[(1,3-BENZOTHIAZOL-6-YLSULFONYL)(3-PHENYLPROPYL)AMINO]-3-HYDROXY-1-PHENYLBUTAN-2-YL}-3-HYDROXYBENZAMIDE ACT:ACETATE ION PO4:PHOSPHATE ION | |||
3sa6 | [A2] | [A2] | [A2] | 1.75 | F71:3-HYDROXY-N-[(2S,3R)-3-HYDROXY-4-([(2S)-2-METHYLBUTYL]{[5-(1,2-OXAZOL-5-YL)THIOPHEN-2-YL]SULFONYL}AMINO)-1-PHENYLBUTAN-2-YL]BENZAMIDE PO4:PHOSPHATE ION | |||
3sa7 | [A2] | [A2] | [A2] | 1.5 | 55A:N~2~-ACETYL-N-[(2S,3R)-4-{(1,3-BENZOTHIAZOL-6-YLSULFONYL)[(2S)-2-METHYLBUTYL]AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]-L-LEUCINAMIDE PO4:PHOSPHATE ION | |||
3sa8 | [A2] | [A2] | [A2] | 1.5 | ACT:ACETATE ION K83:3-HYDROXY-N-[(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]BENZAMIDE PO4:PHOSPHATE ION | |||
3sa9 | [A2] | [A2] | [A2] | 1.7 | A68:N~2~-ACETYL-N-[(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]-L-ISOLEUCINAMIDE ACT:ACETATE ION PO4:PHOSPHATE ION | |||
3saa | [A2] | [A2] | [A2] | 1.95 | 77F:N-[(2S,3R)-4-{(CYCLOHEXYLMETHYL)[(4-METHOXYPHENYL)SULFONYL]AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]-3-HYDROXYBENZAMIDE PO4:PHOSPHATE ION | |||
3sab | [A2] | [A2] | [A2] | 1.5 | F78:3-HYDROXY-N-[(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](3-PHENYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]BENZAMIDE PO4:PHOSPHATE ION | |||
3sac | [A2] | [A2] | [A2] | 1.5 | AF8:3-HYDROXY-N-{(2S,3R)-3-HYDROXY-4-[(2-METHYLPROPYL){[5-(1,2-OXAZOL-5-YL)THIOPHEN-2-YL]SULFONYL}AMINO]-1-PHENYLBUTAN-2-YL}BENZAMIDE PO4:PHOSPHATE ION | |||
3sfc | [A] | [A] | [A] | 2.1 | GOL:GLYCEROL NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE S53:[7-BENZYL-2-(5-FLUORO-2-METHYLPHENOXY)-1-PHENYL-1H-PYRROLO[2,3-C]PYRIDIN-3-YL](PIPERAZIN-1-YL)METHANONE | |||
3skf | [A] | [A] | [A] | 3 | IOD:IODIDE ION PB7:(2S)-2-{(3S)-3-(ACETYLAMINO)-3-[(2S)-BUTAN-2-YL]-2-OXOPYRROLIDIN-1-YL}-N-{(2S,3R)-3-HYDROXY-4-[(3-METHOXYBENZYL)AMINO]-1-PHENYLBUTAN-2-YL}-4-PHENYLBUTANAMIDE | |||
3skg | [A] | [A] | [A] | 2.88 | PB8:(2S)-2-[(3R)-3-(ACETYLAMINO)-3-(2-METHYLPROPYL)-2-OXOPYRROLIDIN-1-YL]-N-{(1R,2S)-3-(3,5-DIFLUOROPHENYL)-1-HYDROXY-1-[(3R)-1,2,3,4-TETRAHYDROISOQUINOLIN-3-YL]PROPAN-2-YL}-4-PHENYLBUTANAMIDE | |||
3slz | [A2] | [A2] | [A2] | 1.4 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE FMT:FORMIC ACID NA:SODIUM ION | |||
3sm1 | [A2][a2] | [A2][a2] | [A2][a2] | 1.5 | FMT:FORMIC ACID IVA:ISOVALERIC ACID STA:STATINE | |||
3sm2 | [A2] | [A2] | [A2] | 1.75 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER | |||
3so9 | [A2] | [A2] | [A2] | 2.87 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
3spk | [A2] | [A2] | [A2] | 1.24 | TPV:N-(3-{(1R)-1-[(6R)-4-HYDROXY-2-OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO-2H-PYRAN-3-YL]PROPYL}PHENYL)-5-(TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE | |||
3sqf | [A] | [A] | [A] | 1.63 | ||||
3st5 | [A2] | [A2] | [A2] | 1.45 | CL:CHLORIDE ION G89:(3R,3AR,5R,6AR)-3-HYDROXYHEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE | |||
3t11 | [A2] | [A2] | [A2] | 2.22 | 3T1:(3S,11S)-11-(3-CHLORO-4-HYDROXY-5-METHOXYPHENYL)-3-PHENYL-2,3,4,5,10,11-HEXAHYDRO-1H-DIBENZO[B,E][1,4]DIAZEPIN-1-ONE BME:BETA-MERCAPTOETHANOL CL:CHLORIDE ION | |||
3t3c | [A2] | [A2] | [A2] | 2.1 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE BME:BETA-MERCAPTOETHANOL SO4:SULFATE ION | |||
3t6i | [A] | [A] | [A] | 1.32 | CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL NC8:(3R)-3-({(4-AMINOBENZYL)[(4-AMINOPHENYL)ACETYL]AMINO}METHYL)-5-{[(4-BROMOBENZOYL)OXY]METHYL}-2,3,4,7-TETRAHYDRO-1H-AZEPINIUM NC9:(3R)-3-({(4-AMINOBENZYL)[(4-AMINOPHENYL)ACETYL]AMINO}METHYL)-5-(HYDROXYMETHYL)-2,3,4,7-TETRAHYDRO-1H-AZEPINIUM SO4:SULFATE ION Z82:4-BROMOBENZOIC ACID | |||
3t7p | [A] | [A] | [A] | 1.35 | 7SP:(2R)-2-AMINO-N___sq___-[(E)-(4-HYDROXYNAPHTHALEN-1-YL)METHYLIDENE]-2-PHENYLETHANEHYDRAZIDE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PGE:TRIETHYLENE GLYCOL | |||
3t7q | [A] | [A] | [A] | 1.3 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL RB4:ETHYL 2-({N-[2-(1H-INDOL-3-YL)ETHYL]GLYCYL}AMINO)-4-PHENYLTHIOPHENE-3-CARBOXYLATE | |||
3t7x | [A] | [A] | [A] | 1.27 | 4SH:N-BENZYL-2-[(MORPHOLIN-4-YLACETYL)AMINO]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE ACT:ACETATE ION GOL:GLYCEROL | |||
3th9 | [A2] | [A2] | [A2] | 1.34 | 9Y9:TERT-BUTYL {(2S,3R)-4-[(4S)-7-FLUORO-4-METHYL-1,1-DIOXIDO-4,5-DIHYDRO-1,2-BENZOTHIAZEPIN-2(3H)-YL]-3-HYDROXY-1-PHENYLBUTAN-2-YL}CARBAMATE | |||
3tkg | [A2] | [A2] | [A2] | 1.36 | CL:CHLORIDE ION GOL:GLYCEROL ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3tkw | [A2] | [A2] | [A2] | 1.55 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
3tl9 | [A2] | [A2] | [A2] | 1.32 | CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3tlh | [A2] | [A2] | [A2] | 2 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE | |||
3tne | [A] | [A] | [A] | 2.4 | RIT:RITONAVIR | |||
3tof | [A2] | [A2] | [A2] | 1.45 | 076:(S)-N-((1R,2S)-1-((2R,3R)-3-BENZYLOXIRAN-2-YL)-1-HYDROXY-3-PHENYLPROPAN-2-YL)-3-METHYL-2-(2-PHENOXYACETAMIDO)BUTANAMIDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE | |||
3tog | [A2] | [A2] | [A2] | 1.24 | 079:(S)-N-((2S,3S,4R,5R)-4-AMINO-3,5-DIHYDROXY-1,6-DIPHENYLHEXAN-2-YL)-3-METHYL-2-(2-PHENOXYACETAMIDO)BUTANAMIDE DMS:DIMETHYL SULFOXIDE | |||
3toh | [A2] | [A2] | [A2] | 1.12 | 079:(S)-N-((2S,3S,4R,5R)-4-AMINO-3,5-DIHYDROXY-1,6-DIPHENYLHEXAN-2-YL)-3-METHYL-2-(2-PHENOXYACETAMIDO)BUTANAMIDE DMS:DIMETHYL SULFOXIDE | |||
3tpj | [A] | [A] | [A] | 1.61 | CL:CHLORIDE ION SO4:SULFATE ION URE:UREA | |||
3tpl | [A] | [A] | [A] | 2.5 | CL:CHLORIDE ION SO4:SULFATE ION | |||
3tpp | [A] | [A] | [A] | 1.6 | 5HA:N-[(1S,2R)-1-BENZYL-3-(CYCLOPROPYLAMINO)-2-HYDROXYPROPYL]-5-[METHYL(METHYLSULFONYL)AMINO]-N___sq___-[(1R)-1-PHENYLETHYL]ISOPHTHALAMIDE CL:CHLORIDE ION SO4:SULFATE ION URE:UREA | |||
3tpr | [A] | [A] | [A] | 2.55 | 5HA:N-[(1S,2R)-1-BENZYL-3-(CYCLOPROPYLAMINO)-2-HYDROXYPROPYL]-5-[METHYL(METHYLSULFONYL)AMINO]-N___sq___-[(1R)-1-PHENYLETHYL]ISOPHTHALAMIDE CL:CHLORIDE ION | |||
3ttp | [A2] | [A2] | [A2] | 2.23 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE BME:BETA-MERCAPTOETHANOL CL:CHLORIDE ION | |||
3u6a | [A] | [A] | [A] | 2.2 | 18P:N-{3-[(2R)-6-AMINO-2,4-DIMETHYL-3-OXO-2,3,4,5-TETRAHYDROPYRAZIN-2-YL]PHENYL}-5-CHLOROPYRIDINE-2-CARBOXAMIDE SO4:SULFATE ION | |||
3u71 | [A2] | [A2] | [A2] | 2.72 | ||||
3u7s | [A2] | [A2] | [A2] | 2.05 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE BME:BETA-MERCAPTOETHANOL | |||
3ucb | [A2] | [A2] | [A2] | 1.38 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
3udh | [A] | [A] | [A] | 1.7 | 091:(3S)-SPIRO[INDOLE-3,3___sq___-PYRROLIDIN]-2(1H)-ONE EDO:1,2-ETHANEDIOL ZN:ZINC ION | |||
3udj | [A] | [A] | [A] | 1.8 | 092:METHYL (3S,5___sq___R)-2-OXO-1,2-DIHYDROSPIRO[INDOLE-3,3___sq___-PYRROLIDINE]-5___sq___-CARBOXYLATE EDO:1,2-ETHANEDIOL PEG:DI(HYDROXYETHYL)ETHER ZN:ZINC ION | |||
3udk | [A] | [A] | [A] | 2.51 | 095:TETRAHYDRO-2H-PYRAN-4-YL (3S,5___sq___R)-2-OXO-1,2-DIHYDROSPIRO[INDOLE-3,3___sq___-PYRROLIDINE]-5___sq___-CARBOXYLATE EDO:1,2-ETHANEDIOL PEG:DI(HYDROXYETHYL)ETHER ZN:ZINC ION | |||
3udm | [A] | [A] | [A] | 1.94 | 09A:BENZYL (3S,5___sq___R)-2-OXO-1,2-DIHYDROSPIRO[INDOLE-3,3___sq___-PYRROLIDINE]-5___sq___-CARBOXYLATE EDO:1,2-ETHANEDIOL PEG:DI(HYDROXYETHYL)ETHER ZN:ZINC ION | |||
3udn | [A] | [A] | [A] | 2.19 | 09B:4-CYANOBENZYL (3S,5___sq___R)-2-OXO-1,2-DIHYDROSPIRO[INDOLE-3,3___sq___-PYRROLIDINE]-5___sq___-CARBOXYLATE EDO:1,2-ETHANEDIOL PEG:DI(HYDROXYETHYL)ETHER ZN:ZINC ION | |||
3udp | [A] | [A] | [A] | 1.95 | 09D:(4S)-6-BROMO-3,4-DIHYDRO-2H-THIOCHROMEN-4-YL (3S,5___sq___R)-2-OXO-1,2-DIHYDROSPIRO[INDOLE-3,3___sq___-PYRROLIDINE]-5___sq___-CARBOXYLATE EDO:1,2-ETHANEDIOL PEG:DI(HYDROXYETHYL)ETHER ZN:ZINC ION | |||
3udq | [A] | [A] | [A] | 2.73 | 09E:(4S)-6-BROMO-1,1-DIOXIDO-3,4-DIHYDRO-2H-THIOCHROMEN-4-YL (3S,5___sq___R)-2-OXO-1,2-DIHYDROSPIRO[INDOLE-3,3___sq___-PYRROLIDINE]-5___sq___-CARBOXYLATE | |||
3udr | [A] | [A] | [A] | 1.95 | 09F:1-CYANOCYCLOHEXYL (3S,5___sq___R)-2-OXO-1,2-DIHYDROSPIRO[INDOLE-3,3___sq___-PYRROLIDINE]-5___sq___-CARBOXYLATE EDO:1,2-ETHANEDIOL PEG:DI(HYDROXYETHYL)ETHER ZN:ZINC ION | |||
3udy | [A] | [A] | [A] | 2 | 09G:3-BROMO-4-CYANOBENZYL (3S,5___sq___R)-2-OXO-1,2-DIHYDROSPIRO[INDOLE-3,3___sq___-PYRROLIDINE]-5___sq___-CARBOXYLATE EDO:1,2-ETHANEDIOL PEG:DI(HYDROXYETHYL)ETHER ZN:ZINC ION | |||
3uf3 | [A2] | [A2] | [A2] | 1.63 | GOL:GLYCEROL Y1:YTTRIUM ION | |||
3ufl | [A] | [A] | [A] | 1.9 | 508:(1R,4___sq___S)-3,4-DIHYDRO-2H-SPIRO[NAPHTHALENE-1,3___sq___-PYRROLIDIN]-4___sq___-YL[(2S,4R)-2,4-DIPHENYLPIPERIDIN-1-YL]METHANONE GOL:GLYCEROL SO4:SULFATE ION | |||
3ufn | [A2] | [A2] | [A2] | 1.45 | CL:CHLORIDE ION ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
3uhl | [A2] | [A2] | [A2] | 2.2 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE SO4:SULFATE ION | |||
3upj | [A2] | [A2] | [A2] | 2.5 | U03:4-HYDROXY-7-METHOXY-3-(1-PHENYL-PROPYL)-CHROMEN-2-ONE | |||
3uqp | [A][a] | [A][a] | [A][a] | 1.77 | BOC:TERT-BUTYL HYDROGEN CARBONATE GNC:N~2~-METHYL-L-GLUTAMINE PDW:METHYL D-PROLINATE PSA:3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID SO4:SULFATE ION ZAE:N-METHYL-D-PHENYLALANINE | |||
3uqr | [A][a] | [A][a] | [A][a] | 3.06 | PLJ:METHYL L-PROLINATE PSA:3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID QSC:(1R)-1-PHENYLETHANAMINE ZAE:N-METHYL-D-PHENYLALANINE ZSC:5-[METHYL(METHYLSULFONYL)AMINO]BENZENE-1,3-DICARBOXYLICACID | |||
3uqu | [A] | [A] | [A] | 1.7 | CL:CHLORIDE ION SO4:SULFATE ION URE:UREA ZPX:N-[(1R)-1-(4-FLUOROPHENYL)ETHYL]-N___sq___-[(2S,3S)-3-HYDROXY-1-PHENYL-4-(1H-PYRAZOL-1-YL)BUTAN-2-YL]-5-[METHYL(METHYLSULFONYL)AMINO]BENZENE-1,3-DICARBOXAMIDE | |||
3uqw | [A] | [A] | [A] | 2.2 | SO4:SULFATE ION ZPY:ETHYL 1-{(2S,3S)-3-[(3-{[(1R)-1-(4-FLUOROPHENYL)ETHYL]CARBAMOYL}-5-[METHYL(METHYLSULFONYL)AMINO]BENZOYL)AMINO]-2-HYDROXY-4-PHENYLBUTYL}-1H-PYRAZOLE-4-CARBOXYLATE | |||
3uqx | [A] | [A] | [A] | 1.7 | CL:CHLORIDE ION SO4:SULFATE ION URE:UREA ZPZ:N-[(1R)-1-(4-FLUOROPHENYL)ETHYL]-N___sq___-[(2S,3S)-3-HYDROXY-4-{4-[(1S)-1-HYDROXYETHYL]-1H-1,2,3-TRIAZOL-1-YL}-1-PHENYLBUTAN-2-YL]-5-[METHYL(METHYLSULFONYL)AMINO]BENZENE-1,3-DICARBOXAMIDE | |||
3uri | [A][a] | [A][a] | [A][a] | 2.1 | 13E:N-[(2S)-2-AMINO-3-PHENYLPROPYL]-L-METHIONINE SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
3urj | [A] | [A] | [A] | 1.9 | SO4:SULFATE ION SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
3url | [A][a] | [A][a] | [A][a] | 2 | PUK:N-[(2S)-2-AMINO-3-PHENYLPROPYL]-L-PHENYLALANINE SO4:SULFATE ION SUI:(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | |||
3utl | [A] | [A] | [A] | 2.61 | ||||
3vcm | [AB] | [AB] | [AB] | 2.93 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
3veu | [A] | [A] | [A] | 1.52 | 0GO:(2S)-N-[(2S,3R)-3-HYDROXY-1-PHENYL-4-{[3-(PROPAN-2-YL)BENZYL]AMINO}BUTAN-2-YL]-2-[(5S)-6-OXO-1-PROPYL-1,7-DIAZASPIRO[4.4]NON-7-YL]PROPANAMIDE | |||
3vf3 | [A] | [A] | [A] | 1.48 | 0GS:(3S,4S,5R)-3-(4-AMINO-3-BROMO-5-FLUOROBENZYL)-5-{[3-(1,1-DIFLUOROETHYL)BENZYL]AMINO}TETRAHYDRO-2H-THIOPYRAN-4-OL 1,1-DIOXIDE | |||
3vf5 | [A2] | [A2] | [A2] | 1.25 | 031:(3AS,5R,6AR)-HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-([(4-METHOXYPHENYL)SULFONYL]{[(2R)-5-OXOPYRROLIDIN-2-YL]METHYL}AMINO)PROPYL]CARBAMATE ACT:ACETATE ION CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
3vf7 | [A2] | [A2] | [A2] | 1.3 | 031:(3AS,5R,6AR)-HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-([(4-METHOXYPHENYL)SULFONYL]{[(2R)-5-OXOPYRROLIDIN-2-YL]METHYL}AMINO)PROPYL]CARBAMATE CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
3vfa | [A2] | [A2] | [A2] | 1.43 | 031:(3AS,5R,6AR)-HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-([(4-METHOXYPHENYL)SULFONYL]{[(2R)-5-OXOPYRROLIDIN-2-YL]METHYL}AMINO)PROPYL]CARBAMATE CL:CHLORIDE ION NA:SODIUM ION | |||
3vfb | [A2] | [A2] | [A2] | 1.55 | 031:(3AS,5R,6AR)-HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-([(4-METHOXYPHENYL)SULFONYL]{[(2R)-5-OXOPYRROLIDIN-2-YL]METHYL}AMINO)PROPYL]CARBAMATE CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
3vg1 | [A] | [A] | [A] | 1.77 | 0GT:(3R,4S,5S)-3-[(3-TERT-BUTYLBENZYL)AMINO]-5-{[3-(2,2-DIFLUOROETHYL)-1H-INDOL-5-YL]METHYL}TETRAHYDRO-2H-THIOPYRAN-4-OL 1,1-DIOXIDE | |||
3vla | [A] | [A] | [A] | 0.95 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE PCA:PYROGLUTAMIC ACID | |||
3vlb | [AB] | [AB] | [AB] | 2.7 | ||||
3vsw | [A] | [A] | [A] | 3 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE R31:(2S,4S,5S)-5-AMINO-N-(3-AMINO-2,2-DIMETHYL-3-OXOPROPYL)-4-HYDROXY-6-{4-[2-(3-METHOXYPROPOXY)PHENYL]-3-OXOPIPERAZIN-1-YL}-2-(PROPAN-2-YL)HEXANAMIDE | |||
3vsx | [A] | [A] | [A] | 2.8 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE R32:(2S,4S,5S)-5-AMINO-N-(3-AMINO-2,2-DIMETHYL-3-OXOPROPYL)-6-[4-(2-CHLOROPHENYL)-2,2-DIMETHYL-5-OXOPIPERAZIN-1-YL]-4-HYDROXY-2-(PROPAN-2-YL)HEXANAMIDE | |||
3vuc | [A] | [A] | [A] | 2.6 | HHE:(2R,4S,5S)-5-AMINO-6-[4-(2-CHLOROPHENYL)-2,2-DIMETHYL-5-OXOPIPERAZIN-1-YL]-2-ETHYL-4-HYDROXY-N-[(1R,2S,3S,5S,7S)-5-HYDROXYTRICYCLO[3.3.1.1~3,7~]DEC-2-YL]HEXANAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
3vv6 | [A] | [A] | [A] | 2.05 | B00:2-AMINO-3-METHYL-6-[(1S,2R)-2-PHENYLCYCLOPROPYL]PYRIMIDIN-4(3H)-ONE GOL:GLYCEROL IOD:IODIDE ION | |||
3vv7 | [A] | [A] | [A] | 2.1 | 0B1:2-AMINO-6-[(1S,2R)-2-(3___sq___-METHOXYBIPHENYL-3-YL)CYCLOPROPYL]-3-METHYLPYRIMIDIN-4(3H)-ONE GOL:GLYCEROL IOD:IODIDE ION | |||
3vv8 | [A] | [A] | [A] | 2.5 | B02:2-AMINO-3-METHYL-6-[(1S,2R)-2-(3___sq___-METHYLBIPHENYL-4-YL)CYCLOPROPYL]PYRIMIDIN-4(3H)-ONE GOL:GLYCEROL | |||
3vyd | [A] | [A] | [A] | 2.81 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE VYD:(3S,5R)-5-{[4-(2-CHLOROPHENYL)-2,2-DIMETHYL-5-OXOPIPERAZIN-1-YL]METHYL}-N-(3-METHYLBUTYL)PIPERIDINE-3-CARBOXAMIDE | |||
3vye | [A] | [A] | [A] | 2.7 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE VYE:(3S,5R)-5-[4-(2-CHLOROPHENYL)-2,2-DIMETHYL-5-OXOPIPERAZIN-1-YL]-N-(3-METHYLBUTYL)PIPERIDINE-3-CARBOXAMIDE | |||
3vyf | [A] | [A] | [A] | 2.8 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE VYF:(3S,5R)-5-[4-(2-CHLOROPHENYL)-2,2-DIMETHYL-5-OXOPIPERAZIN-1-YL]-N-(2,6-DIMETHYLHEPTAN-4-YL)PIPERIDINE-3-CARBOXAMIDE | |||
3wb4 | [A] | [A] | [A] | 2.25 | 0B3:(6R)-2-AMINO-3,6-DIMETHYL-6-(2-PHENYLETHYL)-5,6-DIHYDROPYRIMIDIN-4(3H)-ONE GOL:GLYCEROL IOD:IODIDE ION | |||
3wb5 | [A] | [A] | [A] | 2.5 | 0B4:(6S)-2-AMINO-3,6-DIMETHYL-6-[(1R,2R)-2-PHENYLCYCLOPROPYL]-5,6-DIHYDROPYRIMIDIN-4(3H)-ONE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL IOD:IODIDE ION | |||
3wsj | [A2] | [A2] | [A2] | 2.4 | MK1:N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARYBUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE PG4:TETRAETHYLENE GLYCOL SO4:SULFATE ION | |||
3wz6 | [A] | [A] | [A] | 1.4 | ACT:ACETATE ION IXZ:N-BENZYL-2-[(N-BENZYLGLYCYL)AMINO]-4-PHENYLTHIOPHENE-3-CARBOXAMIDE PEG:DI(HYDROXYETHYL)ETHER PG4:TETRAETHYLENE GLYCOL PG6:1-(2-METHOXY-ETHOXY)-2-{2-[2-(2-METHOXY-ETHOXY]-ETHOXY}-ETHANE | |||
3wz7 | [A] | [A] | [A] | 1.9 | DMS:DIMETHYL SULFOXIDE IXY:N-BENZYL-2-({N-[2-(1H-INDOL-3-YL)ETHYL]GLYCYL}AMINO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE | |||
3wz8 | [A] | [A] | [A] | 1.45 | DMS:DIMETHYL SULFOXIDE IXV:N-BENZYL-4-PHENYL-2-[(N-PHENYL-BETA-ALANYL)AMINO]THIOPHENE-3-CARBOXAMIDE PEG:DI(HYDROXYETHYL)ETHER | |||
3zkg | [A] | [A] | [A] | 1.9 | B3P:2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL | |||
3zki | [A] | [A] | [A] | 2.4 | WZV:5-(2,2,2-TRIFLUORO-ETHOXY)-PYRIDINE-2-CARBOXYLIC ACID [3-((S)-2-AMINO-1,4-DIMETHYL-6-OXO-1,4,5,6-TETRAHYDRO-PYRIMIDIN-4-YL)-PHENYL]-AMIDE | |||
3zkm | [ABC] | [ABC] | [A2B] | 1.85 | DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PCA:PYROGLUTAMIC ACID SO4:SULFATE ION | |||
3zkn | [ABC] | [ABC] | [A2B] | 2 | DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PCA:PYROGLUTAMIC ACID SO4:SULFATE ION WZV:5-(2,2,2-TRIFLUORO-ETHOXY)-PYRIDINE-2-CARBOXYLIC ACID[3-((S)-2-AMINO-1,4-DIMETHYL-6-OXO-1,4,5,6-TETRAHYDRO-PYRIMIDIN-4-YL)-PHENYL]-AMIDE | |||
3zkq | [AB] | [AB] | [AB] | 1.51 | B3P:2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL CL:CHLORIDE ION | |||
3zks | [AB] | [AB] | [AB] | 2.11 | WZV:5-(2,2,2-TRIFLUORO-ETHOXY)-PYRIDINE-2-CARBOXYLIC ACID [3-((S)-2-AMINO-1,4-DIMETHYL-6-OXO-1,4,5,6-TETRAHYDRO-PYRIMIDIN-4-YL)-PHENYL]-AMIDE | |||
3zkx | [ABC] | [A2B] | [A2B] | 2.37 | CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE | |||
3zl7 | [AB] | [AB] | [AB] | 3.2 | ||||
3zlq | [A2B2] | [A2B2] | [A2B2] | 2.1 | 6T9:5-ETHOXY-PYRIDINE-2-CARBOXYLIC ACID [3-((R)-2-AMINO-5,5-DIFLUORO-4-METHYL-5,6-DIHYDRO-4H-[1,3]OXAZIN-4-YL)-4-FLUORO-PHENYL]-AMIDE | |||
3zmg | [A] | [A] | [A] | 1.74 | 6Z0:N-[3-[(4R)-2-AZANYLIDENE-5,5-BIS(FLUORANYL)-4-METHYL-1,3-OXAZINAN-4-YL]-4-FLUORANYL-PHENYL]-5-CYANO-PYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
3zov | [A] | [A] | [A] | 2.1 | DMS:DIMETHYL SULFOXIDE NA:SODIUM ION WZV:5-(2,2,2-TRIFLUORO-ETHOXY)-PYRIDINE-2-CARBOXYLIC ACID[3-((S)-2-AMINO-1,4-DIMETHYL-6-OXO-1,4,5,6-TETRAHYDRO-PYRIMIDIN-4-YL)-PHENYL]-AMIDE | |||
3zps | [A2] | [A2] | [A2] | 1.55 | CL:CHLORIDE ION EQM:METHYL N-[(2S)-1-[2-[(4-BROMOPHENYL)METHYL]-2-[(4R)-5-[[(2S)-3,3-DIMETHYL-1-OXIDANYLIDENE-1-(PROP-2-ENYLAMINO)BUTAN-2-YL]AMINO]-4-OXIDANYL-5-OXIDANYLIDENE-4-(PHENYLMETHYL)PENTYL]HYDRAZINYL]-3,3-DIMETHYL-1-OXIDANYLIDENE-BUTAN-2-YL]CARBAMATE | |||
3zpt | [A2] | [A2] | [A2] | 1.54 | CL:CHLORIDE ION M8Y:METHYL N-[(2S)-1-[2-[(4-BROMOPHENYL)METHYL]-2-[3-[(3Z,8S,11R)-11-OXIDANYL-7,10-BIS(OXIDANYLIDENE)-8-PROPAN-2-YL-6,9-DIAZABICYCLO[11.2.2]HEPTADECA-1(16),3,13(17),14-TETRAEN-11-YL]PROPYL]HYDRAZINYL]-3,3-DIMETHYL-1-OXIDANYLIDENE-BUTAN-2-YL]CARBAMATE | |||
3zpu | [A2] | [A2] | [A2] | 1.8 | CL:CHLORIDE ION M8B:METHYL N-[(2S)-1-[2-[(4-BROMOPHENYL)METHYL]-2-[3-[(3Z,8S,11R)-8-TERT-BUTYL-11-OXIDANYL-7,10-BIS(OXIDANYLIDENE)-6,9-DIAZABICYCLO[11.2.2]HEPTADECA-1(15),3,13,16-TETRAEN-11-YL]PROPYL]HYDRAZINYL]-3,3-DIMETHYL-1-OXIDANYLIDENE-BUTAN-2-YL]CARBAMATE | |||
4a4q | [A2] | [A2] | [A2] | 1.8 | UX9:METHYL [(2S)-1-{2-(2-{(3R,4S)-3-BENZYL-4-HYDROXY-1-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-2-OXOPYRROLIDIN-3-YL}ETHYL)-2-[4-(PYRIDIN-4-YL)BENZYL]HYDRAZINYL}-3,3-DIMETHYL-1-OXOBUTAN-2-YL]CARBAMATE | |||
4a6b | [A2] | [A2] | [A2] | 1.8 | QG8:METHYL ((S)-1-(2-([1,1___sq___-BIPHENYL]-4-YLMETHYL)-2-(3-((3S,4S)-3-BENZYL-4-HYDROXY-1-((1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL)-2-OXOPYRROLIDIN-3-YL)PROPYL)HYDRAZINYL)-3,3-DIMETHYL-1-OXOBUTAN-2-YL)CARBAMATE | |||
4a6c | [A2] | [A2] | [A2] | 1.5 | QG9:METHYL ((S)-1-(2-(3-((3S,4S)-3-BENZYL-4-HYDROXY-1-((1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL)-2-OXOPYRROLIDIN-3-YL)PROPYL)-2-(4-(PYRIDIN-4-YL)BENZYL)HYDRAZINYL)-3,3-DIMETHYL-1-OXOBUTAN-2-YL)CARBAMATE | |||
4aa8 | [A2] | [A2] | [A2] | 1.8 | CL:CHLORIDE ION | |||
4aa9 | [A] | [A] | [A] | 1.6 | GOL:GLYCEROL NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4acu | [A] | [A] | [A] | 1.75 | ACT:ACETATE ION QN7:(8S)-3,3-DIFLUORO-8-(2___sq___-FLUORO-3___sq___-METHOXYBIPHENYL-3-YL)-8-PYRIDIN-4-YL-2,3,4,8-TETRAHYDROIMIDAZO[1,5-A]PYRIMIDIN-6-AMINE | |||
4acx | [A] | [A] | [A] | 2 | ACT:ACETATE ION S8Z:(8R)-8-[4-(DIFLUOROMETHOXY)PHENYL]-3,3-DIFLUORO-8-[3-(3-METHOXYPROP-1-YN-1-YL)PHENYL]-2,3,4,8-TETRAHYDROIMIDAZO[1,5-A]PYRIMIDIN-6-AMINE | |||
4amt | [A2] | [A2] | [A2] | 2.6 | BMA:BETA-D-MANNOPYRANOSE FUC:ALPHA-L-FUCOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4ape | [A] | [A] | [A] | 2.1 | ||||
4apr | [A][a] | [A][a] | [A][a] | 2.5 | STA:STATINE | |||
4auc | [A][a] | [A][a] | [A][a] | 1.6 | CD:CADMIUM ION EDO:1,2-ETHANEDIOL IVA:ISOVALERIC ACID NA:SODIUM ION STA:STATINE | |||
4azy | [A] | [A] | [A] | 1.79 | 7F3:(1S)-4-FLUORO-1-(4-FLUORO-3-PYRIMIDIN-5-YLPHENYL)-1-[2-(TRIFLUOROMETHYL)PYRIDIN-4-YL]-1H-ISOINDOL-3-AMINE ACT:ACETATE ION NA:SODIUM ION | |||
4b00 | [A] | [A] | [A] | 1.83 | ACT:ACETATE ION I6X:5-{(1R)-3-AMINO-4-FLUORO-1-[3-(5-PROP-1-YN-1-YLPYRIDIN-3-YL)PHENYL]-1H-ISOINDOL-1-YL}-1-ETHYL-3-METHYLPYRIDIN-2(1H)-ONE | |||
4b05 | [A] | [A] | [A] | 1.8 | 32D:(1S)-1-[2-(DIFLUOROMETHYL)PYRIDIN-4-YL]-4-FLUORO-1-(3-PYRIMIDIN-5-YLPHENYL)-1H-ISOINDOL-3-AMINE ACT:ACETATE ION NA:SODIUM ION | |||
4b0q | [A] | [A] | [A] | 1.87 | ACT:ACETATE ION GMF:2-[[3-(3-METHOXYPHENYL)PHENYL]-(4-PYRIDYL)METHYL]GUANIDINE | |||
4b1c | [A] | [A] | [A] | 1.95 | 1B1:(2R)-2-CYCLOPROPYL-5-METHYL-2-[3-(5-PROP-1-YN-1-YLPYRIDIN-3-YL)PHENYL]-2H-IMIDAZOL-4-AMINE DMS:DIMETHYL SULFOXIDE | |||
4b1d | [A] | [A] | [A] | 1.95 | 6TG:(2S)-2-(4-METHOXY-3,5-DIMETHYLPHENYL)-5-METHYL-2-(3-PYRIMIDIN-5-YLPHENYL)-2H-IMIDAZOL-4-AMINE ACT:ACETATE ION | |||
4b1e | [A] | [A] | [A] | 1.95 | 6T6:(2R)-2-METHYL-5-PHENYL-2-(3-PYRIDIN-3-YLPHENYL)-2,3-DIHYDRO-1H-IMIDAZOL-4-AMINE | |||
4b70 | [A] | [A] | [A] | 1.6 | WM9:(2S)-2-[3-(3-CHLOROPHENYL)PHENYL]-2-METHYL-5,6-DIHYDRO-1,3-OXAZIN-4-AMINE | |||
4b72 | [A] | [A] | [A] | 1.6 | 2FB:(6R)-6-(4-METHOXYPHENYL)-2-METHYL-6-(3-PYRIMIDIN-5-YLPHENYL)PYRROLO[3,4-D][1,3]THIAZOL-4-AMINE | |||
4b77 | [A] | [A] | [A] | 1.8 | 54M:(5R)-5-(4-METHOXYPHENYL)-5-(3-PYRIMIDIN-5-YLPHENYL)-3,4-DIHYDROPYRROL-2-AMINE DMS:DIMETHYL SULFOXIDE | |||
4b78 | [A] | [A] | [A] | 1.5 | KGG:(3R,5R)-3-METHOXY-5-(4-METHOXYPHENYL)-5-(3-PYRIDIN-3-YLPHENYL)-3,4-DIHYDROPYRROL-2-AMINE | |||
4bek | [A] | [A] | [A] | 2.39 | DMS:DIMETHYL SULFOXIDE NA:SODIUM ION XK0:(4S)-4-(4-METHOXYPHENYL)-4-METHYL-5,6-DIHYDRO-1,3-THIAZIN-2-AMINE | |||
4bel | [AB] | [AB] | [AB] | 1.85 | B3P:2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL CL:CHLORIDE ION | |||
4bfb | [AB] | [AB] | [AB] | 2.21 | B3P:2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL | |||
4bfd | [A] | [A] | [A] | 2.3 | 8T3:N-[3-[(1S,3S,6S)-5-AZANYL-3-METHYL-4-AZABICYCLO[4.1.0]HEPT-4-EN-3-YL]-4-FLUORANYL-PHENYL]-5-CHLORANYL-PYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4cku | [A4] | [A4] | [A4] | 1.85 | P2F:5-[1,1-BIS(OXIDANYLIDENE)-1,2-THIAZINAN-2-YL]-N3-[(2S,3R)-4-[2-(3-METHOXYPHENYL)PROPAN-2-YLAMINO]-3-OXIDANYL-1-PHENYL-BUTAN-2-YL]-N1,N1-DIPROPYL-BENZENE-1,3-DICARBOXAMIDE | |||
4cms | [A] | [A] | [A] | 2.2 | ||||
4coe | [A2] | [A2] | [A2] | 2.45 | CL:CHLORIDE ION M17:METHYL {(2S)-1-[2-(BIPHENYL-4-YLMETHYL)-2-{(4R)-4-HYDROXY-5-{[(2S)-3-METHYL-1-OXO-1-(PROP-2-EN-1-YLAMINO)BUTAN-2-YL]AMINO}-5-OXO-4-[4-(PROP-2-EN-1-YL)BENZYL]PENTYL}HYDRAZINYL]-3,3-DIMETHYL-1-OXOBUTAN-2-YL}CARBAMATE | |||
4cp7 | [A2] | [A2] | [A2] | 1.8 | 9MW:METHYL [(2S)-1-(2-{(4R)-4-HYDROXY-5-{[(2S)-3-METHYL-1-OXO-1-(PROP-2-EN-1-YLAMINO)BUTAN-2-YL]AMINO}-5-OXO-4-[4-(PROP-2-EN-1-YL)BENZYL]PENTYL}-2-[4-(PYRIDIN-4-YL)BENZYL]HYDRAZINYL)-3,3-DIMETHYL-1-OXOBUTAN-2-YL]CARBAMATE CL:CHLORIDE ION | |||
4cpq | [A2] | [A2] | [A2] | 2.35 | 9MW:METHYL [(2S)-1-(2-{(4R)-4-HYDROXY-5-{[(2S)-3-METHYL-1-OXO-1-(PROP-2-EN-1-YLAMINO)BUTAN-2-YL]AMINO}-5-OXO-4-[4-(PROP-2-EN-1-YL)BENZYL]PENTYL}-2-[4-(PYRIDIN-4-YL)BENZYL]HYDRAZINYL)-3,3-DIMETHYL-1-OXOBUTAN-2-YL]CARBAMATE CL:CHLORIDE ION | |||
4cpr | [A2] | [A2] | [A2] | 1.8 | 378:METHYL ~{N}-[(2~{S})-3,3-DIMETHYL-1-[2-[(4~{R})-5-[[(2~{S})-3-METHYL-1-OXIDANYLIDENE-1-(PROP-2-ENYLAMINO)BUTAN-2-YL]AMINO]-4-OXIDANYL-5-OXIDANYLIDENE-4-[(4-PROP-2-ENYLPHENYL)METHYL]PENTYL]-2-[(4-THIOPHEN-2-YLPHENYL)METHYL]HYDRAZINYL]-1-OXIDANYLIDENE-BUTAN-2-YL]CARBAMATE CL:CHLORIDE ION | |||
4cps | [A2] | [A2] | [A2] | 1.55 | 1T8:METHYL [(2S)-1-(2-{3-[(3R,6S,10Z)-3-HYDROXY-4,7-DIOXO-6-(PROPAN-2-YL)-5,8-DIAZABICYCLO[11.2.2]HEPTADECA-1(15),10,13,16-TETRAEN-3-YL]PROPYL}-2-[4-(PYRIDIN-3-YL)BENZYL]HYDRAZINYL)-3,3-DIMETHYL-1-OXOBUTAN-2-YL]CARBAMATE CL:CHLORIDE ION | |||
4cpt | [A2] | [A2] | [A2] | 1.7 | 1T8:METHYL [(2S)-1-(2-{3-[(3R,6S,10Z)-3-HYDROXY-4,7-DIOXO-6-(PROPAN-2-YL)-5,8-DIAZABICYCLO[11.2.2]HEPTADECA-1(15),10,13,16-TETRAEN-3-YL]PROPYL}-2-[4-(PYRIDIN-3-YL)BENZYL]HYDRAZINYL)-3,3-DIMETHYL-1-OXOBUTAN-2-YL]CARBAMATE CL:CHLORIDE ION | |||
4cpu | [A2] | [A2] | [A2] | 1.82 | CL:CHLORIDE ION V78:METHYL N-[(2S)-1-[2-[[4-[(3S)-3,4-DIHYDROTHIOPHEN-3-YL]PHENYL]METHYL]-2-[3-[(3Z,8S,11R)-11-OXIDANYL-7,10-BIS(OXIDANYLIDENE)-8-PROPAN-2-YL-6,9-DIAZABICYCLO[11.2.2]HEPTADECA-1(16),3,13(17),14-TETRAEN-11-YL]PROPYL]HYDRAZINYL]-3,3-DIMETHYL-1-OXIDANYLIDENE-BUTAN-2-YL]CARBAMATE | |||
4cpw | [A2] | [A2] | [A2] | 1.7 | CL:CHLORIDE ION V78:METHYL N-[(2S)-1-[2-[[4-[(3S)-3,4-DIHYDROTHIOPHEN-3-YL]PHENYL]METHYL]-2-[3-[(3Z,8S,11R)-11-OXIDANYL-7,10-BIS(OXIDANYLIDENE)-8-PROPAN-2-YL-6,9-DIAZABICYCLO[11.2.2]HEPTADECA-1(16),3,13(17),14-TETRAEN-11-YL]PROPYL]HYDRAZINYL]-3,3-DIMETHYL-1-OXIDANYLIDENE-BUTAN-2-YL]CARBAMATE | |||
4cpx | [A2] | [A2] | [A2] | 1.85 | CL:CHLORIDE ION J3W:METHYL ~{N}-[(2~{S})-3,3-DIMETHYL-1-[2-[3-[(3~{R},6~{S},10~{Z})-3-OXIDANYL-4,7-BIS(OXIDANYLIDENE)-6-PROPAN-2-YL-5,8-DIAZABICYCLO[11.2.2]HEPTADECA-1(16),10,13(17),14-TETRAEN-3-YL]PROPYL]-2-[(4-THIOPHEN-2-YLPHENYL)METHYL]HYDRAZINYL]-1-OXIDANYLIDENE-BUTAN-2-YL]CARBAMATE | |||
4d83 | [A] | [A] | [A] | 2.4 | 0GT:(3R,4S,5S)-3-[(3-TERT-BUTYLBENZYL)AMINO]-5-{[3-(2,2-DIFLUOROETHYL)-1H-INDOL-5-YL]METHYL}TETRAHYDRO-2H-THIOPYRAN-4-OL 1,1-DIOXIDE | |||
4d85 | [A] | [A] | [A] | 2.65 | 0GU:(3R,4S,5S)-3-[(3-TERT-BUTYLBENZYL)AMINO]-5-[(4,4,7___sq___-TRIFLUORO-1___sq___,2___sq___-DIHYDROSPIRO[CYCLOHEXANE-1,3___sq___-INDOL]-5___sq___-YL)METHYL]TETRAHYDRO-2H-THIOPYRAN-4-OL 1,1-DIOXIDE IOD:IODIDE ION | |||
4d88 | [A] | [A] | [A] | 1.7 | BXQ:(3S,4S,5R)-3-{4-AMINO-3-FLUORO-5-[(2S)-3,3,3-TRIFLUORO-2-HYDROXYPROPYL]BENZYL}-5-[(3-TERT-BUTYLBENZYL)AMINO]TETRAHYDRO-2H-THIOPYRAN-4-OL 1,1-DIOXIDE | |||
4d89 | [A] | [A] | [A] | 1.65 | BXD:(3S,4S,5R)-3-(4-AMINO-3-{[(2R)-3-ETHOXY-1,1,1-TRIFLUOROPROPAN-2-YL]OXY}-5-FLUOROBENZYL)-5-[(3-TERT-BUTYLBENZYL)AMINO]TETRAHYDRO-2H-THIOPYRAN-4-OL 1,1-DIOXIDE | |||
4d8c | [A] | [A] | [A] | 2.07 | BXD:(3S,4S,5R)-3-(4-AMINO-3-{[(2R)-3-ETHOXY-1,1,1-TRIFLUOROPROPAN-2-YL]OXY}-5-FLUOROBENZYL)-5-[(3-TERT-BUTYLBENZYL)AMINO]TETRAHYDRO-2H-THIOPYRAN-4-OL 1,1-DIOXIDE SO4:SULFATE ION | |||
4dfg | [A2] | [A2] | [A2] | 1.23 | 0JV:METHYL N-[(3S,3AR,5R,6AR)-5-[[(2S,3R)-4-[(4-METHOXYPHENYL)SULFONYL-(2-METHYLPROPYL)AMINO]-3-OXIDANYL-1-PHENYL-BUTAN-2-YL]CARBAMOYLOXY]-3,3A,4,5,6,6A-HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-3-YL]CARBAMATE CL:CHLORIDE ION NA:SODIUM ION | |||
4dh6 | [A] | [A] | [A] | 2.5 | 0KN:(2R)-N-[(2S,3R)-1-(1,3-BENZODIOXOL-5-YL)-4-{[(4___sq___S)-6___sq___-(2,2-DIMETHYLPROPYL)-3___sq___,4___sq___-DIHYDROSPIRO[CYCLOBUTANE-1,2___sq___-PYRANO[2,3-B]PYRIDIN]-4___sq___-YL]AMINO}-3-HYDROXYBUTAN-2-YL]-2-METHOXYPROPANAMIDE GOL:GLYCEROL IOD:IODIDE ION | |||
4di2 | [A] | [A] | [A] | 2 | 0K9:(2R)-N-{(2S,3R)-4-{[(4___sq___S)-6___sq___-(2,2-DIMETHYLPROPYL)-3___sq___,4___sq___-DIHYDROSPIRO[CYCLOBUTANE-1,2___sq___-PYRANO[2,3-B]PYRIDIN]-4___sq___-YL]AMINO}-3-HYDROXY-1-[3-(1,3-THIAZOL-2-YL)PHENYL]BUTAN-2-YL}-2-METHOXYPROPANAMIDE GOL:GLYCEROL | |||
4djo | [A2] | [A2] | [A2] | 1.78 | ACT:ACETATE ION GOL:GLYCEROL MK5:2-[(DICHLOROACETYL)AMINO]ETHYL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL][(2S)-2-METHYLBUTYL]AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE PO4:PHOSPHATE ION | |||
4djp | [A2] | [A2] | [A2] | 1.4 | M73:METHYL (2S)-3-({[(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL][(2S)-2-METHYLBUTYL]AMINO}-1-PHENYLBUTAN-2-YL]CARBAMOYL}OXY)-2-METHYLPROPANOATE PO4:PHOSPHATE ION | |||
4djq | [A2] | [A2] | [A2] | 1.4 | M86:2-(2-OXOIMIDAZOLIDIN-1-YL)ETHYL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL][(2S)-2-METHYLBUTYL]AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE PO4:PHOSPHATE ION | |||
4djr | [A2] | [A2] | [A2] | 1.55 | 0KJ:[(2S)-5-OXOPYRROLIDIN-2-YL]METHYL [(2S,3R)-4-{(1,3-BENZOTHIAZOL-6-YLSULFONYL)[(2S)-2-METHYLBUTYL]AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]CARBAMATE PO4:PHOSPHATE ION | |||
4dju | [A] | [A] | [A] | 1.8 | 0KK:(2E)-2-IMINO-3-METHYL-5,5-DIPHENYLIMIDAZOLIDIN-4-ONE TLA:L(+)-TARTARIC ACID | |||
4djv | [A] | [A] | [A] | 1.73 | 0KM:(2E,5R)-2-IMINO-5-(3___sq___-METHOXYBIPHENYL-3-YL)-3-METHYL-5-PHENYLIMIDAZOLIDIN-4-ONE TLA:L(+)-TARTARIC ACID | |||
4djw | [A] | [A] | [A] | 1.9 | 0KP:(2E,5R)-2-IMINO-3-METHYL-5-PHENYL-5-[3-(PYRIDIN-3-YL)PHENYL]IMIDAZOLIDIN-4-ONE TLA:L(+)-TARTARIC ACID | |||
4djx | [A] | [A] | [A] | 1.5 | 0KQ:(2E,5R)-5-[3-(5-CHLOROPYRIDIN-3-YL)PHENYL]-5-CYCLOPROPYL-2-IMINO-3-METHYLIMIDAZOLIDIN-4-ONE TLA:L(+)-TARTARIC ACID | |||
4djy | [A] | [A] | [A] | 1.86 | 0KR:(2E,5R)-5-CYCLOPROPYL-2-IMINO-3-METHYL-5-{3-[5-(PROP-1-YN-1-YL)PYRIDIN-3-YL]PHENYL}IMIDAZOLIDIN-4-ONE TLA:L(+)-TARTARIC ACID | |||
4dpf | [A] | [A] | [A] | 1.8 | 0LG:N-[(4S,8E,11S)-4-[(1R)-1-HYDROXY-2-{[3-(PROPAN-2-YL)BENZYL]AMINO}ETHYL]-2,13-DIOXO-11-PHENYL-6-OXA-3,12-DIAZABICYCLO[12.3.1]OCTADECA-1(18),8,14,16-TETRAEN-16-YL]-N-METHYLMETHANESULFONAMIDE | |||
4dpi | [A] | [A] | [A] | 1.9 | 0N1:(4S,8E,11R)-4-[(1R)-1-HYDROXY-2-{[3-(PROPAN-2-YL)BENZYL]AMINO}ETHYL]-16-METHYL-11-PHENYL-6-OXA-3,12-DIAZABICYCLO[12.3.1]OCTADECA-1(18),8,14,16-TETRAENE-2,13-DIONE | |||
4dqb | [A2] | [A2] | [A2] | 1.5 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL PO4:PHOSPHATE ION | |||
4dqc | [A2] | [A2] | [A2] | 1.94 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE GOL:GLYCEROL PO4:PHOSPHATE ION | |||
4dqe | [A2] | [A2] | [A2] | 1.3 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION | |||
4dqf | [A2] | [A2] | [A2] | 1.9 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE EDO:1,2-ETHANEDIOL GOL:GLYCEROL SO4:SULFATE ION | |||
4dqg | [A2] | [A2] | [A2] | 2.79 | ACT:ACETATE ION GOL:GLYCEROL HGU:N-HYDROXYGUANIDINE OXY:OXYGEN MOLECULE PO4:PHOSPHATE ION | |||
4dqh | [A2] | [A2] | [A2] | 1.79 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE GOL:GLYCEROL | |||
4dus | [A] | [A] | [A] | 2.5 | 0MP:N-((2S,3R)-1-(4-FLUOROPHENYL)-3-HYDROXY-4-((6___sq___-NEOPENTYL-3___sq___,4___sq___-DIHYDROSPIRO[CYCLOBUTANE-1,2___sq___-PYRANO[2,3-B]PYRIDIN]-4___sq___-YL)AMINO)BUTAN-2-YL)ACETAMIDE GOL:GLYCEROL IOD:IODIDE ION | |||
4dv9 | [A][a] | [A][a] | [A][a] | 2.08 | 2OP:(2S)-2-HYDROXYPROPANOIC ACID GNC:N~2~-METHYL-L-GLUTAMINE PLJ:METHYL L-PROLINATE PSA:3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID SO4:SULFATE ION ZAE:N-METHYL-D-PHENYLALANINE | |||
4dvf | [A][a] | [A][a] | [A][a] | 1.8 | PLJ:METHYL L-PROLINATE PSA:3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID QSC:(1R)-1-PHENYLETHANAMINE USC:5-[(METHYLSULFONYL)AMINO]BENZENE-1,3-DICARBOXYLIC ACID ZAE:N-METHYL-D-PHENYLALANINE | |||
4e43 | [A2][a] | [A2][a] | [A2][a] | 1.54 | ACT:ACETATE ION BME:BETA-MERCAPTOETHANOL DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4ehc | [A] | [A] | [A] | 1.98 | EDO:1,2-ETHANEDIOL MSE:SELENOMETHIONINE ZN:ZINC ION | |||
4ej8 | [A2] | [A2] | [A2] | 2.35 | 1F1:1H-INDOLE-6-CARBOXYLIC ACID DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL | |||
4ejd | [A2][a] | [A2][a] | [A2][a] | 1.1 | 1F1:1H-INDOLE-6-CARBOXYLIC ACID BME:BETA-MERCAPTOETHANOL GOL:GLYCEROL IVA:ISOVALERIC ACID STA:STATINE | |||
4ejk | [A2][a] | [A2][a] | [A2][a] | 1.79 | IOP:INDOLYLPROPIONIC ACID IVA:ISOVALERIC ACID STA:STATINE | |||
4ejl | [A2] | [A2] | [A2] | 2.45 | DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL IOP:INDOLYLPROPIONIC ACID PEG:DI(HYDROXYETHYL)ETHER | |||
4ep2 | [A][a] | [A][a] | [A][a] | 1.9 | GOL:GLYCEROL PO4:PHOSPHATE ION | |||
4ep3 | [A][a] | [A][a] | [A][a] | 1.81 | BME:BETA-MERCAPTOETHANOL GOL:GLYCEROL | |||
4epj | [A][a] | [A][a] | [A][a] | 1.69 | ACT:ACETATE ION BME:BETA-MERCAPTOETHANOL DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4eq0 | [A][a] | [A][a] | [A][a] | 1.7 | ACT:ACETATE ION BME:BETA-MERCAPTOETHANOL EDO:1,2-ETHANEDIOL GOL:GLYCEROL PO4:PHOSPHATE ION | |||
4eqj | [A][a] | [A][a] | [A][a] | 1.8 | EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4er1 | [A] | [A] | [A] | 2 | 0ZP:N-[(1R,2R,4R)-1-(CYCLOHEXYLMETHYL)-2-HYDROXY-6-METHYL-4-{[(2R)-2-METHYLBUTYL]CARBAMOYL}HEPTYL]-3-(1H-IMIDAZOL-3-IUM-4-YL)-N~2~-[3-NAPHTHALEN-1-YL-2-(NAPHTHALEN-1-YLMETHYL)PROPANOYL]-L-ALANINAMIDE | |||
4er2 | [A][a] | [A][a] | [A][a] | 2 | IVA:ISOVALERIC ACID SO4:SULFATE ION STA:STATINE | |||
4er4 | [A][a] | [A][a] | [A][a] | 2.1 | LAV:N-[(2S)-2-AMINO-4-METHYLPENTYL]-L-VALINE | |||
4ewo | [A] | [A] | [A] | 1.8 | 996:N-[(2S,3R)-4-{[(4S)-2-(2,2-DIMETHYLPROPYL)-6,6-DIMETHYL-4,5,6,7-TETRAHYDRO-2H-INDAZOL-4-YL]AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]ACETAMIDE | |||
4exg | [A] | [A] | [A] | 1.8 | 916:N-[(2S,3R)-4-{[(4S)-6-(2,2-DIMETHYLPROPYL)-2,2-DIMETHYL-3,4-DIHYDRO-2H-THIENO[2,3-B]PYRAN-4-YL]AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]ACETAMIDE | |||
4exh | [A2][a2] | [A2][a2] | [A2][a2] | 2 | ACE:ACETYL GROUP FMT:FORMIC ACID STA:STATINE | |||
4eyr | [A2] | [A2] | [A2] | 1.8 | RIT:RITONAVIR | |||
4f73 | [A2][a2] | [A2][a2] | [A2][a2] | 1.9 | ACT:ACETATE ION GOL:GLYCEROL | |||
4f74 | [A2][a] | [A2][a] | [A2][a] | 2.2 | ||||
4f75 | [A2][ab] | [A2][ab] | [A2][ab] | 1.7 | ACT:ACETATE ION GOL:GLYCEROL | |||
4f76 | [A2][ab] | [A2][ab] | [A2][ab] | 1.85 | ||||
4fae | [A2][a] | [A2][a] | [A2][a] | 2.3 | ||||
4faf | [A2][a] | [A2][a] | [A2][a] | 2.1 | ||||
4fco | [A] | [A] | [A] | 1.76 | 0U4:N-[(2S,3R)-4-{[2-(1-BENZYLPIPERIDIN-4-YL)ETHYL]AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]-5-[METHYL(METHYLSULFONYL)AMINO]-N___sq___-[(1R)-1-PHENYLETHYL]BENZENE-1,3-DICARBOXAMIDE SO4:SULFATE ION URE:UREA | |||
4fe6 | [A2] | [A2] | [A2] | 2 | 0TQ:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL {(2S,3R)-3-HYDROXY-4-[({(3Z)-3-[1-(METHYLAMINO)ETHYLIDENE]-2-OXO-2,3-DIHYDRO-1H-INDOL-5-YL}SULFONYL)(2-METHYLPROPYL)AMINO]-1-PHENYLBUTAN-2-YL}CARBAMATE | |||
4fgx | [A][a] | [A][a] | [A][a] | 1.59 | 2OP:(2S)-2-HYDROXYPROPANOIC ACID GNC:N~2~-METHYL-L-GLUTAMINE PEG:DI(HYDROXYETHYL)ETHER PSA:3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID SO4:SULFATE ION URE:UREA ZAE:N-METHYL-D-PHENYLALANINE | |||
4fiv | [A2] | [A2] | [A2] | 1.8 | LP1:4-[2-(2-ACETYLAMINO-3-NAPHTALEN-1-YL-PROPIONYLAMINO)-4-METHYL-PENTANOYLAMINO]-3-HYDROXY-6-METHYL-HEPTANOICACID [1-(1-CARBAMOYL-2-NAPHTHALEN-1-YL-ETHYLCARBAMOYL)-PROPYL]-AMIDE | |||
4fl8 | [A2][ab] | [A2][ab] | [A2][ab] | 1.2 | CL:CHLORIDE ION GOL:GLYCEROL IL0:(2S,3S)-2-AMINO-3-METHYLPENTANE-1,1-DIOL | |||
4flg | [A2][abc] | [A2][abc] | [A2][abc] | 1.31 | CL:CHLORIDE ION GLU:GLUTAMIC ACID GOL:GLYCEROL ILE:ISOLEUCINE NA:SODIUM ION | |||
4fm6 | [A2][a] | [A2][a] | [A2][a] | 1.4 | CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
4fm7 | [A] | [A] | [A] | 1.56 | 0UP:4-{[(5R,7S)-1-(3-FLUOROPHENYL)-3,7-DIMETHYL-2,2-DIOXIDO-2-THIA-1,3,8-TRIAZASPIRO[4.5]DEC-8-YL]METHYL}-2-(PROPAN-2-YLOXY)PHENOL ZN:ZINC ION | |||
4fm8 | [A] | [A] | [A] | 1.9 | 0UQ:(5R,7S)-1-(3-FLUOROPHENYL)-3,7-DIMETHYL-8-[3-(PROPAN-2-YLOXY)BENZYL]-2-THIA-1,3,8-TRIAZASPIRO[4.5]DECANE 2,2-DIOXIDE EDO:1,2-ETHANEDIOL ZN:ZINC ION | |||
4fri | [A] | [A] | [A] | 2.3 | DMS:DIMETHYL SULFOXIDE DWA:(4R)-4-[3-(2-FLUOROPYRIDIN-3-YL)PHENYL]-4-(4-METHOXYPHENYL)-4,5-DIHYDRO-1,3-OXAZOL-2-AMINE IOD:IODIDE ION | |||
4frj | [A] | [A] | [A] | 1.95 | DMS:DIMETHYL SULFOXIDE DWB:(4S)-2___sq___-(5-CHLORO-2-FLUOROPHENYL)-7___sq___-METHOXYSPIRO[1,3-OXAZOLE-4,9___sq___-XANTHEN]-2-AMINE GOL:GLYCEROL IOD:IODIDE ION | |||
4frk | [A] | [A] | [A] | 2.1 | DWD:(4S)-2___sq___-(2-METHYLPROPOXY)-7___sq___-(PYRIMIDIN-5-YL)SPIRO[1,3-OXAZOLE-4,9___sq___-XANTHEN]-2-AMINE GOL:GLYCEROL IOD:IODIDE ION | |||
4frs | [A] | [A] | [A] | 1.7 | 0V6:(2Z,6S)-6-{3-CHLORO-5-[5-(PROP-1-YN-1-YL)PYRIDIN-3-YL]THIOPHEN-2-YL}-2-IMINO-3,6-DIMETHYLTETRAHYDROPYRIMIDIN-4(1H)-ONE | |||
4fs4 | [A2] | [A2] | [A2] | 1.74 | H24:(6S)-2-AMINO-6-(3___sq___-METHOXYBIPHENYL-3-YL)-3,6-DIMETHYL-5,6-DIHYDROPYRIMIDIN-4(3H)-ONE TLA:L(+)-TARTARIC ACID | |||
4fse | [A] | [A] | [A] | 2.65 | 0VA:N-[N-(4-AMINO-3,5-DICHLOROBENZYL)CARBAMIMIDOYL]-3-(4-METHOXYPHENYL)-5-METHYL-1,2-THIAZOLE-4-CARBOXAMIDE IOD:IODIDE ION | |||
4fsl | [A] | [A] | [A] | 2.5 | 0VB:N-{N-[4-(ACETYLAMINO)-3-CHLORO-5-METHYLBENZYL]CARBAMIMIDOYL}-3-(4-METHOXYPHENYL)-5-METHYL-1,2-THIAZOLE-4-CARBOXAMIDE IOD:IODIDE ION | |||
4gb2 | [A2] | [A2] | [A2] | 1.79 | 0LQ:(4AS,7AS)-1,4-BIS(DIPHENYLMETHYL)HEXAHYDRO-1H-PYRROLO[3,4-B]PYRAZINE-2,3-DIONE CL:CHLORIDE ION GOL:GLYCEROL | |||
4gid | [A] | [A] | [A] | 2 | 0GH:N-[(2S)-1-({(2S,3R)-3-HYDROXY-1-[(2-METHYLPROPYL)AMINO]-1-OXOBUTAN-2-YL}AMINO)-3-PHENYLPROPAN-2-YL]-5-[METHYL(METHYLSULFONYL)AMINO]-N___sq___-[(1R)-1-PHENYLETHYL]BENZENE-1,3-DICARBOXAMIDE LPD:L-PROLINAMIDE | |||
4gj5 | [A] | [A] | [A] | 2.4 | 0LR:(3R,4R)-3-(NAPHTHALEN-2-YLMETHOXY)-4-PHENYLPIPERIDINE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
4gj6 | [A] | [A] | [A] | 2.58 | 0LS:N-{[(3S,4S)-4-BENZYLPYRROLIDIN-3-YL]METHYL}-4-CHLORO-N-PHENYLANILINE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4gj7 | [A] | [A] | [A] | 2.8 | 0LT:N-{[(3S,4S)-4-BENZYLPYRROLIDIN-3-YL]METHYL}-4-METHOXY-3-(3-METHOXYPROPOXY)-N-(PROPAN-2-YL)BENZAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4gj8 | [A] | [A] | [A] | 2.5 | 0LU:(2S)-1-(PYRROLIDIN-1-YL)-3-(9H-THIOXANTHEN-9-YL)PROPAN-2-OL 0LW:(2R)-1-(PYRROLIDIN-1-YL)-3-(9H-THIOXANTHEN-9-YL)PROPAN-2-OL NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4gj9 | [A] | [A] | [A] | 2.6 | 0M2:(2R)-1-(3,8-DIHYDRODIBENZO[B,F]PYRROLO[3,4-D]AZEPIN-2(1H)-YL)PROPAN-2-OL NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
4gja | [A] | [A] | [A] | 2.6 | 0M3:(3S,5R)-N-(2,2-DIPHENYLETHYL)-5-{[(4-METHYLPHENYL)SULFONYL]AMINO}PIPERIDINE-3-CARBOXAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4gjb | [A] | [A] | [A] | 2.75 | 0ME:(3S)-N-(9H-XANTHEN-9-YLMETHYL)PIPERIDINE-3-CARBOXAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4gjc | [A] | [A] | [A] | 2.4 | 0MJ:(3S,5R)-5-{[(4-METHYLPHENYL)SULFONYL]AMINO}-N-(9H-XANTHEN-9-YLMETHYL)PIPERIDINE-3-CARBOXAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4gjd | [A] | [A] | [A] | 2.65 | 0N0:(3S,5R)-N-{[9-(4-METHOXYBUTYL)-9H-XANTHEN-9-YL]METHYL}-5-{[(4-METHYLPHENYL)SULFONYL]AMINO}PIPERIDINE-3-CARBOXAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4gmi | [A] | [A] | [A] | 1.8 | 0XA:(4S,8E)-4-[(1R)-2-{[2-(5-TERT-BUTYL-1,3-OXAZOL-2-YL)PROPAN-2-YL]AMINO}-1-HYDROXYETHYL]-16-METHYL-6-OXA-3-AZABICYCLO[12.3.1]OCTADECA-1(18),8,14,16-TETRAENE-2,13-DIONE ACT:ACETATE ION GOL:GLYCEROL | |||
4gye | [A2][a] | [A2][a] | [A2][a] | 2.27 | ILO:N5-IMINOETHYL-L-ORNITHINE NLE:NORLEUCINE PUK:N-[(2S)-2-AMINO-3-PHENYLPROPYL]-L-PHENYLALANINE | |||
4gzf | [A2][a] | [A2][a] | [A2][a] | 2.05 | DC0:N-[(2S)-2-AMINO-4-METHYLPENTYL]-L-PHENYLALANINE ILO:N5-IMINOETHYL-L-ORNITHINE NLE:NORLEUCINE | |||
4h1e | [A] | [A] | [A] | 1.9 | 10J:3-{5-[(2E,4AR,7AR)-6-BENZOYL-2-IMINO-3-METHYL-4-OXOOCTAHYDRO-7AH-PYRROLO[3,4-D]PYRIMIDIN-7A-YL]THIOPHEN-3-YL}BENZONITRILE | |||
4h3f | [A] | [A] | [A] | 1.7 | 10O:3-{5-[(2E,4AR,7AR)-2-IMINO-6-(6-METHOXYPYRIDIN-2-YL)-3-METHYL-4-OXOOCTAHYDRO-7AH-PYRROLO[3,4-D]PYRIMIDIN-7A-YL]THIOPHEN-3-YL}BENZONITRILE TLA:L(+)-TARTARIC ACID | |||
4h3g | [A] | [A] | [A] | 1.85 | 10Q:2-{(2E,4AR,7AR)-7A-[4-(3-CYANOPHENYL)THIOPHEN-2-YL]-2-IMINO-3-METHYL-4-OXOOCTAHYDRO-6H-PYRROLO[3,4-D]PYRIMIDIN-6-YL}PYRIDINE-3-CARBONITRILE TLA:L(+)-TARTARIC ACID | |||
4h3i | [A] | [A] | [A] | 1.96 | 10V:3-{5-[(2E,4AR,7AR)-2-IMINO-6-(3-METHOXYPYRIDIN-2-YL)-3-METHYL-4-OXOOCTAHYDRO-7AH-PYRROLO[3,4-D]PYRIMIDIN-7A-YL]THIOPHEN-3-YL}BENZONITRILE TLA:L(+)-TARTARIC ACID | |||
4h3j | [A] | [A] | [A] | 1.6 | 10W:2-FLUORO-5-{5-[(2E,4AR,7AR)-2-IMINO-3-METHYL-4-OXO-6-PHENYLOCTAHYDRO-7AH-PYRROLO[3,4-D]PYRIMIDIN-7A-YL]THIOPHEN-2-YL}BENZONITRILE TLA:L(+)-TARTARIC ACID | |||
4ha5 | [A] | [A] | [A] | 1.83 | 13W:3-{5-[(2E,4S)-2-IMINO-1,4-DIMETHYL-6-OXOHEXAHYDROPYRIMIDIN-4-YL]THIOPHEN-3-YL}BENZONITRILE TLA:L(+)-TARTARIC ACID | |||
4hdb | [A2] | [A2] | [A2] | 1.49 | CL:CHLORIDE ION G52:(3R,3AS,3BR,6AS,7AS)-OCTAHYDRODIFURO[2,3-B:3___sq___,2___sq___-D]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}PROPYL]CARBAMATE NA:SODIUM ION | |||
4hdf | [A2] | [A2] | [A2] | 1.29 | CL:CHLORIDE ION G52:(3R,3AS,3BR,6AS,7AS)-OCTAHYDRODIFURO[2,3-B:3___sq___,2___sq___-D]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}PROPYL]CARBAMATE | |||
4hdp | [A2] | [A2] | [A2] | 1.22 | CL:CHLORIDE ION G52:(3R,3AS,3BR,6AS,7AS)-OCTAHYDRODIFURO[2,3-B:3___sq___,2___sq___-D]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}PROPYL]CARBAMATE NA:SODIUM ION | |||
4he9 | [A2] | [A2] | [A2] | 1.06 | CL:CHLORIDE ION G52:(3R,3AS,3BR,6AS,7AS)-OCTAHYDRODIFURO[2,3-B:3___sq___,2___sq___-D]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}PROPYL]CARBAMATE NA:SODIUM ION | |||
4heg | [A2] | [A2] | [A2] | 1.46 | G52:(3R,3AS,3BR,6AS,7AS)-OCTAHYDRODIFURO[2,3-B:3___sq___,2___sq___-D]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}PROPYL]CARBAMATE | |||
4hla | [A2] | [A2] | [A2] | 1.95 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
4hvp | [A2] | [A2] | [A2] | 2.3 | 2NC:N-{(2S)-2-[(N-ACETYL-L-THREONYL-L-ISOLEUCYL)AMINO]HEXYL}-L-NORLEUCYL-L-GLUTAMINYL-N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHINAMIDE ABA:ALPHA-AMINOBUTYRIC ACID | |||
4hzt | [A] | [A] | [A] | 1.8 | 0ZA:3-{(1S)-1-[(6-CHLORO-3,3-DIMETHYL-3,4-DIHYDROISOQUINOLIN-1-YL)AMINO]-2-PHENYLETHYL}-1,2,4-OXADIAZOL-5(2H)-ONE ZN:ZINC ION | |||
4i0d | [A] | [A] | [A] | 1.91 | 1B7:N-(6-CHLORO-3,3-DIMETHYL-3,4-DIHYDROISOQUINOLIN-1-YL)-3-(4-PROPYLTHIOPHEN-3-YL)-L-ALANINE ZN:ZINC ION | |||
4i0e | [A] | [A] | [A] | 1.7 | 1B8:3-[2-BROMO-4-(1H-PYRAZOL-4-YL)THIOPHEN-3-YL]-N-(6-CHLORO-3,3-DIMETHYL-3,4-DIHYDROISOQUINOLIN-1-YL)-L-ALANINE ZN:ZINC ION | |||
4i0f | [A] | [A] | [A] | 1.8 | 1BF:N-(6-CHLORO-3,3-DIMETHYL-3,4-DIHYDROISOQUINOLIN-1-YL)-3-[4-(1H-PYRAZOL-4-YL)THIOPHEN-3-YL]-L-ALANINE ZN:ZINC ION | |||
4i0g | [A] | [A] | [A] | 1.78 | 1B9:3-(4-BROMOTHIOPHEN-3-YL)-N-(6-CHLORO-3,3-DIMETHYL-3,4-DIHYDROISOQUINOLIN-1-YL)-L-ALANINE ZN:ZINC ION | |||
4i0h | [A] | [A] | [A] | 2.2 | 1BL:(2R)-5-{[(2S,3R)-4-{[1-(3-TERT-BUTYLPHENYL)CYCLOHEXYL]AMINO}-1-(3,5-DIFLUOROPHENYL)-3-HYDROXYBUTAN-2-YL]AMINO}-2-HYDROXY-5-OXOPENTANOIC ACID | |||
4i0i | [A] | [A] | [A] | 2.2 | 957:N-[(1S,2R)-1-(3,5-DIFLUOROBENZYL)-3-({1-[4-(2,2-DIMETHYLPROPYL)THIOPHEN-2-YL]CYCLOPROPYL}AMINO)-2-HYDROXYPROPYL]ACETAMIDE | |||
4i0j | [A] | [A] | [A] | 1.99 | 842:N-[(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-3-({1-[3-(1H-PYRAZOL-1-YL)PHENYL]CYCLOHEXYL}AMINO)PROPYL]ACETAMIDE ZN:ZINC ION | |||
4i0z | [A] | [A] | [A] | 1.8 | 1BB:2-{(1S)-1-[(6-CHLORO-3,3-DIMETHYL-3,4-DIHYDROISOQUINOLIN-1-YL)AMINO]-2-PHENYLETHYL}-4-OXO-1,4-DIHYDROPYRIMIDINE-5-CARBONITRILE ZN:ZINC ION | |||
4i10 | [A] | [A] | [A] | 2.07 | 1BS:2-{(1S)-1-[(6-CHLORO-3,3-DIMETHYL-3,4-DIHYDROISOQUINOLIN-1-YL)AMINO]-2-PHENYLETHYL}PYRIDO[4,3-D]PYRIMIDIN-4(1H)-ONE ZN:ZINC ION | |||
4i11 | [A] | [A] | [A] | 1.89 | 1CH:N-(3,3-DIMETHYL-3,4-DIHYDROISOQUINOLIN-1-YL)-L-PHENYLALANINE ZN:ZINC ION | |||
4i12 | [A] | [A] | [A] | 1.78 | 1BC:2-{(1S)-1-{[(1Z)-6-CHLORO-3,3-DIMETHYL-3,4-DIHYDROISOQUINOLIN-1(2H)-YLIDENE]AMINO}-2-[2-PROPYL-4-(1H-PYRAZOL-4-YL)THIOPHEN-3-YL]ETHYL}PYRIMIDIN-4(5H)-ONE NA:SODIUM ION ZN:ZINC ION | |||
4i1c | [A] | [A] | [A] | 2 | 1BE:N-(6-CHLORO-3,3-DIMETHYL-3,4-DIHYDROISOQUINOLIN-1-YL)-3-[2-PROPYL-4-(1H-PYRAZOL-4-YL)THIOPHEN-3-YL]-L-ALANINE ZN:ZINC ION | |||
4i8w | [A2] | [A2] | [A2] | 1.96 | G07:4-{[(2R,3S)-3-({[(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YLOXY]CARBONYL}AMINO)-2-HYDROXY-4-PHENYLBUTYL](2-METHYLPROPYL)SULFAMOYL}BENZOIC ACID | |||
4i8z | [A2] | [A2] | [A2] | 1.75 | G08:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(2S,3R)-4-{[(4-CARBAMOYLPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]CARBAMATE | |||
4ivs | [A] | [A] | [A] | 2.64 | VSI:N-{N-[4-(ACETYLAMINO)-3,5-DICHLOROBENZYL]CARBAMIMIDOYL}-2-(6-CYANO-1H-INDOL-1-YL)ACETAMIDE | |||
4ivt | [A] | [A] | [A] | 1.6 | SO4:SULFATE ION VTI:N-{N-[4-(ACETYLAMINO)-3,5-DICHLOROBENZYL]CARBAMIMIDOYL}-2-(1H-INDOL-1-YL)ACETAMIDE | |||
4j0p | [A] | [A] | [A] | 1.97 | 1H8:N-{3-[(4S)-2-AMINO-4-METHYL-5,6-DIHYDRO-4H-1,3-OXAZIN-4-YL]-4-FLUOROPHENYL}-5-CYANOPYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4j0t | [A] | [A] | [A] | 2.05 | 6T9:5-ETHOXY-PYRIDINE-2-CARBOXYLIC ACID [3-((R)-2-AMINO-5,5-DIFLUORO-4-METHYL-5,6-DIHYDRO-4H-[1,3]OXAZIN-4-YL)-4-FLUORO-PHENYL]-AMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4j0v | [A] | [A] | [A] | 1.94 | 1H7:N-{3-[(4R,5R)-2-AMINO-5-FLUORO-4-METHYL-5,6-DIHYDRO-4H-1,3-OXAZIN-4-YL]-4-FLUOROPHENYL}-5-CYANOPYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4j0y | [A] | [A] | [A] | 1.77 | 1H6:N-{3-[(4R,5S)-2-AMINO-5-FLUORO-4-METHYL-5,6-DIHYDRO-4H-1,3-OXAZIN-4-YL]-4-FLUOROPHENYL}-5-CYANOPYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4j0z | [A] | [A] | [A] | 2.13 | 1H5:N-{3-[(4S,5R)-2-AMINO-5-FLUORO-4-(FLUOROMETHYL)-5,6-DIHYDRO-4H-1,3-OXAZIN-4-YL]-4-FLUOROPHENYL}-5-CYANOPYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4j17 | [A] | [A] | [A] | 1.81 | 1HQ:N-{3-[(4S)-2-AMINO-4-(DIFLUOROMETHYL)-5,6-DIHYDRO-4H-1,3-OXAZIN-4-YL]-4-FLUOROPHENYL}-5-CYANOPYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4j1c | [A] | [A] | [A] | 2.01 | 1HO:N-{3-[(4S)-2-AMINO-5,5-DIFLUORO-4-(FLUOROMETHYL)-5,6-DIHYDRO-4H-1,3-OXAZIN-4-YL]-4-FLUOROPHENYL}-5-CYANOPYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4j1e | [A] | [A] | [A] | 1.78 | 1HM:N-{3-[(4S,6S)-2-AMINO-4-(FLUOROMETHYL)-6-(TRIFLUOROMETHYL)-5,6-DIHYDRO-4H-1,3-OXAZIN-4-YL]-4-FLUOROPHENYL}-5-CYANOPYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4j1f | [A] | [A] | [A] | 2.25 | 1HL:N-{3-[(4S,6S)-2-AMINO-4-METHYL-6-(TRIFLUOROMETHYL)-5,6-DIHYDRO-4H-1,3-OXAZIN-4-YL]-4-FLUOROPHENYL}-5-CYANOPYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4j1h | [A] | [A] | [A] | 2.2 | 1HJ:N-{3-[(4S,6R)-2-AMINO-4-METHYL-6-(TRIFLUOROMETHYL)-5,6-DIHYDRO-4H-1,3-OXAZIN-4-YL]-4-FLUOROPHENYL}-5-CYANOPYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4j1i | [A] | [A] | [A] | 2.05 | 1HH:N-{3-[(4R,5R,6R)-2-AMINO-5-FLUORO-4-METHYL-6-(TRIFLUOROMETHYL)-5,6-DIHYDRO-4H-1,3-OXAZIN-4-YL]-4-FLUOROPHENYL}-5-CYANOPYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4j1k | [A] | [A] | [A] | 2.18 | 1HG:N-{3-[(4R,5R,6S)-2-AMINO-5-FLUORO-4-METHYL-6-(TRIFLUOROMETHYL)-5,6-DIHYDRO-4H-1,3-OXAZIN-4-YL]-4-FLUOROPHENYL}-5-CYANOPYRIDINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
4j54 | [A2] | [A2] | [A2] | 1.55 | ACT:ACETATE ION G52:(3R,3AS,3BR,6AS,7AS)-OCTAHYDRODIFURO[2,3-B:3___sq___,2___sq___-D]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}PROPYL]CARBAMATE IOD:IODIDE ION | |||
4j55 | [A2] | [A2] | [A2] | 1.31 | 031:(3AS,5R,6AR)-HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-([(4-METHOXYPHENYL)SULFONYL]{[(2R)-5-OXOPYRROLIDIN-2-YL]METHYL}AMINO)PROPYL]CARBAMATE | |||
4j5j | [A2] | [A2] | [A2] | 1.8 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER CL:CHLORIDE ION | |||
4jec | [A2] | [A2] | [A2] | 2.01 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER CL:CHLORIDE ION | |||
4joo | [A] | [A] | [A] | 1.8 | 1M4:(4R)-2___sq___-AMINO-6-BROMO-1___sq___,2,2-TRIMETHYL-2,3-DIHYDROSPIRO[CHROMENE-4,4___sq___-IMIDAZOL]-5___sq___(1___sq___H)-ONE NI:NICKEL (II) ION | |||
4jp9 | [A] | [A] | [A] | 1.8 | 1M5:(4R)-2___sq___-AMINO-6-(3-CHLOROPHENYL)-1___sq___,2,2-TRIMETHYL-2,3-DIHYDROSPIRO[CHROMENE-4,4___sq___-IMIDAZOL]-5___sq___(1___sq___H)-ONE NI:NICKEL (II) ION | |||
4jpc | [A] | [A] | [A] | 1.8 | 1M6:3-[(4R)-2___sq___-AMINO-1___sq___,2,2-TRIMETHYL-5___sq___-OXO-1___sq___,2,3,5___sq___-TETRAHYDROSPIRO[CHROMENE-4,4___sq___-IMIDAZOL]-6-YL]BENZONITRILE NI:NICKEL (II) ION | |||
4jpe | [A] | [A] | [A] | 1.8 | 1M7:(4R)-2-AMINO-1,3___sq___,3___sq___-TRIMETHYL-7___sq___-(PYRIMIDIN-5-YL)-3___sq___,4___sq___-DIHYDRO-2___sq___H-SPIRO[IMIDAZOLE-4,1___sq___-NAPHTHALEN]-5(1H)-ONE NI:NICKEL (II) ION | |||
4k4p | [A2] | [A2] | [A2] | 2.31 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE NO3:NITRATE ION | |||
4k4q | [A2] | [A2] | [A2] | 1.8 | 06B:3-BROMO-2,6-DIMETHOXYBENZOIC ACID 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE BME:BETA-MERCAPTOETHANOL DMS:DIMETHYL SULFOXIDE NO3:NITRATE ION | |||
4k4r | [A2] | [A2] | [A2] | 1.8 | 27B:1-BROMONAPHTHALENE-2-CARBOXYLIC ACID 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE BR:BROMIDE ION DMS:DIMETHYL SULFOXIDE NO3:NITRATE ION | |||
4k8s | [A] | [A] | [A] | 2.39 | 1QT:(3S)-3-[(1R)-2-{[(4S)-6-ETHYL-3,4-DIHYDROSPIRO[CHROMENE-2,1___sq___-CYCLOBUTAN]-4-YL]AMINO}-1-HYDROXYETHYL]-4-AZABICYCLO[11.3.1]HEPTADECA-1(17),13,15-TRIEN-5-ONE | |||
4k9h | [A] | [A] | [A] | 2.29 | 1QU:1-CYCLOPENTYL-N-[(2S,3R)-3-HYDROXY-1-PHENYL-4-{[3-(TRIFLUOROMETHYL)BENZYL]AMINO}BUTAN-2-YL]-6-OXO-5-(2-OXOPYRROLIDIN-1-YL)-1,6-DIHYDROPYRIDINE-3-CARBOXAMIDE | |||
4kb9 | [A2] | [A2] | [A2] | 1.29 | ACT:ACETATE ION CL:CHLORIDE ION G79:(3AR,3BR,4S,7AR,8AS)-DECAHYDROFURO[2,3-B][1]BENZOFURAN-4-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE GOL:GLYCEROL NA:SODIUM ION | |||
4ke0 | [A] | [A] | [A] | 2.3 | 1R8:(3S)-3-[(1R)-2-{[(4S)-6-ETHYL-3,4-DIHYDROSPIRO[CHROMENE-2,1___sq___-CYCLOBUTAN]-4-YL]AMINO}-1-HYDROXYETHYL]-4-AZABICYCLO[10.3.1]HEXADECA-1(16),12,14-TRIEN-5-ONE GOL:GLYCEROL SO4:SULFATE ION | |||
4ke1 | [A] | [A] | [A] | 1.91 | 1R6:(12S)-12-[(1R)-2-{[(4S)-6-ETHYL-3,4-DIHYDROSPIRO[CHROMENE-2,1___sq___-CYCLOBUTAN]-4-YL]AMINO}-1-HYDROXYETHYL]-1,13-DIAZATRICYCLO[13.3.1.1~6,10~]ICOSA-6(20),7,9,15(19),16-PENTAENE-14,18-DIONE GOL:GLYCEROL IOD:IODIDE ION | |||
4kup | [A] | [A] | [A] | 1.31 | 1TZ:(2S)-2-AZANYL-3-(3H-INDOL-3-YL)-N-[(E)-(2,4,6-TRIMETHYLPHENYL)METHYLIDENEAMINO]PROPANAMIDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4l1a | [AB] | [A2] | [A2] | 1.9 | AB1:N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE | |||
4l6b | [A] | [A] | [A] | 1.37 | 1VS:N-ETHYL-2-({N-[2-(1H-INDOL-3-YL)ETHYL]GLYCYL}AMINO)-4-PHENYLTHIOPHENE-3-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4l7g | [A] | [A] | [A] | 1.38 | 1W0:(3AS,7AR)-7A-[3-(PYRIMIDIN-5-YL)PHENYL]-3A,6,7,7A-TETRAHYDRO-4H-PYRANO[4,3-D][1,3]OXAZOL-2-AMINE DMS:DIMETHYL SULFOXIDE | |||
4l7h | [A] | [A] | [A] | 1.85 | 1W1:2-[(3AR,7AR)-2-AMINO-7A-(2,4-DIFLUOROPHENYL)-3A,6,7,7A-TETRAHYDRO[1,3]OXAZOLO[5,4-C]PYRIDIN-5(4H)-YL]PYRIDINE-3-CARBONITRILE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE | |||
4l7j | [A] | [A] | [A] | 1.65 | 1W2:2-[(3AS,7AR)-2-AMINO-3A-(2,4-DIFLUOROPHENYL)-3A,6,7,7A-TETRAHYDRO[1,3]OXAZOLO[4,5-C]PYRIDIN-5(4H)-YL]PYRIDINE-3-CARBONITRILE ACT:ACETATE ION | |||
4lap | [A] | [A] | [A] | 1.12 | 1VT:N-BENZYL-2-[(N-BENZYL-BETA-ALANYL)AMINO]-4-PHENYLTHIOPHENE-3-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4lbt | [A] | [A] | [A] | 1.25 | 1TZ:(2S)-2-AZANYL-3-(3H-INDOL-3-YL)-N-[(E)-(2,4,6-TRIMETHYLPHENYL)METHYLIDENEAMINO]PROPANAMIDE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4lc7 | [A] | [A] | [A] | 1.7 | 1WP:(3AR,7AR)-3A-[3-(5-CHLOROPYRIDIN-3-YL)PHENYL]-3A,4,5,6,7,7A-HEXAHYDRO-1,3-BENZOXAZOL-2-AMINE NI:NICKEL (II) ION | |||
4lhh | [A] | [A] | [A] | 1.73 | 1TZ:(2S)-2-AZANYL-3-(3H-INDOL-3-YL)-N-[(E)-(2,4,6-TRIMETHYLPHENYL)METHYLIDENEAMINO]PROPANAMIDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4ll3 | [A2] | [A2] | [A2] | 1.95 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
4lp9 | [A][a] | [A][a] | [A][a] | 1.35 | 22G:N-[(2S)-2-AMINO-3-PHENYLPROPYL]-L-TYROSINE GOL:GLYCEROL SO4:SULFATE ION | |||
4lxa | [A] | [A] | [A] | 1.95 | 1YS:(1R,3S,4S,5R)-3-{4-AMINO-3-FLUORO-5-[(1,1,1,3,3,3-HEXAFLUOROPROPAN-2-YL)OXY]BENZYL}-5-[(3-TERT-BUTYLBENZYL)AMINO]TETRAHYDRO-2H-THIOPYRAN-4-OL 1-OXIDE GOL:GLYCEROL PO4:PHOSPHATE ION | |||
4lxk | [A] | [A] | [A] | 2.05 | 1YT:(1R,3S,4S,5R)-3-(4-AMINO-3-FLUORO-5-{[(2R)-1,1,1-TRIFLUORO-3-METHOXYPROPAN-2-YL]OXY}BENZYL)-5-[(3-TERT-BUTYLBENZYL)AMINO]TETRAHYDRO-2H-THIOPYRAN-4-OL 1-OXIDE GOL:GLYCEROL | |||
4lxm | [A] | [A] | [A] | 2.3 | 1YU:(1S,3S,4S,5R)-3-{4-AMINO-3-FLUORO-5-[(1,1,1,3,3,3-HEXAFLUOROPROPAN-2-YL)OXY]BENZYL}-5-[(3-TERT-BUTYLBENZYL)AMINO]TETRAHYDRO-2H-THIOPYRAN-4-OL 1-OXIDE | |||
4m8x | [A2] | [A2] | [A2] | 2.05 | KGQ:DIETHYL ({4-[(2S,3R)-2-({[(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YLOXY]CARBONYL}AMINO)-3-HYDROXY-4-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}BUTYL]PHENOXY}METHYL)PHOSPHONATE | |||
4m8y | [A2] | [A2] | [A2] | 2.22 | KGQ:DIETHYL ({4-[(2S,3R)-2-({[(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YLOXY]CARBONYL}AMINO)-3-HYDROXY-4-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}BUTYL]PHENOXY}METHYL)PHOSPHONATE | |||
4mc1 | [A2] | [A2] | [A2] | 1.39 | 526:(3S)-TETRAHYDROFURAN-3-YL {(2S,3R)-4-[(4S)-4-TERT-BUTYL-7-FLUORO-1,1-DIOXIDO-4,5-DIHYDRO-1,2-BENZOTHIAZEPIN-2(3H)-YL]-3-HYDROXY-1-PHENYLBUTAN-2-YL}CARBAMATE CL:CHLORIDE ION | |||
4mc2 | [A2] | [A2] | [A2] | 1.56 | 525:(3S)-TETRAHYDROFURAN-3-YL {(2S,3R)-4-[(4R)-4-TERT-BUTYL-7-FLUORO-1,1-DIOXIDO-4,5-DIHYDRO-1,2-BENZOTHIAZEPIN-2(3H)-YL]-3-HYDROXY-1-PHENYLBUTAN-2-YL}CARBAMATE CL:CHLORIDE ION | |||
4mc6 | [A2] | [A2] | [A2] | 1.31 | 23K:1-TERT-BUTYL-3-{(2S,3R)-4-[(4R)-7-FLUORO-1,1-DIOXIDO-4-(PROPAN-2-YL)-4,5-DIHYDRO-1,2-BENZOTHIAZEPIN-2(3H)-YL]-3-HYDROXY-1-PHENYLBUTAN-2-YL}UREA CL:CHLORIDE ION EDO:1,2-ETHANEDIOL | |||
4mc9 | [A2] | [A2] | [A2] | 1.19 | 23L:(3S)-TETRAHYDROFURAN-3-YL {(2S,3R)-4-[(4R)-7-FLUORO-1,1-DIOXIDO-4-(PROPAN-2-YL)-4,5-DIHYDRO-1,2-BENZOTHIAZEPIN-2(3H)-YL]-3-HYDROXY-1-PHENYLBUTAN-2-YL}CARBAMATE CL:CHLORIDE ION EDO:1,2-ETHANEDIOL | |||
4n00 | [A] | [A] | [A] | 1.8 | 2EX:(4R,4A___sq___S,10A___sq___S)-2-AMINO-8___sq___-(2-FLUOROPYRIDIN-3-YL)-1-METHYL-3___sq___,4___sq___,4A___sq___,10A___sq___-TETRAHYDRO-1___sq___H-SPIRO[IMIDAZOLE-4,10___sq___-PYRANO[4,3-B]CHROMEN]-5(1H)-ONE NI:NICKEL (II) ION | |||
4njs | [A2] | [A2] | [A2] | 1.8 | G08:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(2S,3R)-4-{[(4-CARBAMOYLPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]CARBAMATE | |||
4njt | [A2] | [A2] | [A2] | 1.95 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
4nju | [A2] | [A2] | [A2] | 1.8 | TPV:N-(3-{(1R)-1-[(6R)-4-HYDROXY-2-OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO-2H-PYRAN-3-YL]PROPYL}PHENYL)-5-(TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE | |||
4njv | [A2] | [A2] | [A2] | 1.8 | RIT:RITONAVIR | |||
4nkk | [A2] | [A2] | [A2] | 1.8 | ||||
4npt | [A2] | [A2] | [A2] | 1.66 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE GOL:GLYCEROL | |||
4npu | [A2] | [A2] | [A2] | 1.5 | ||||
4obd | [A2][a] | [A2][a] | [A2][a] | 1.9 | EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4obf | [A2][a] | [A2][a] | [A2][a] | 1.68 | ACT:ACETATE ION EDO:1,2-ETHANEDIOL GOL:GLYCEROL PO4:PHOSPHATE ION | |||
4obg | [A2][a] | [A2][a] | [A2][a] | 1.78 | EDO:1,2-ETHANEDIOL GOL:GLYCEROL PO4:PHOSPHATE ION | |||
4obh | [A2][a] | [A2][a] | [A2][a] | 1.85 | ACT:ACETATE ION EDO:1,2-ETHANEDIOL GOL:GLYCEROL PO4:PHOSPHATE ION | |||
4obj | [A2][a] | [A2][a] | [A2][a] | 1.75 | ACT:ACETATE ION EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4obk | [A2][a] | [A2][a] | [A2][a] | 1.65 | ACT:ACETATE ION EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4obz | [A2B2] | [A2B2] | [A4] | 2.9 | 2S4:2-(3,4-DIMETHOXYPHENYL)-N-[N-(4-METHYLBENZYL)CARBAMIMIDOYL]ACETAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
4oc6 | [A2B2] | [A2B2] | [A4] | 2.64 | 2S1:2-BROMO-N-[(2S,3S)-4-{[2-(2,4-DICHLOROPHENYL)ETHYL][3-(1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)PROPANOYL]AMINO}-3-HYDROXY-1-(3-PHENOXYPHENYL)BUTAN-2-YL]-4,5-DIMETHOXYBENZAMIDE BMA:BETA-D-MANNOPYRANOSE GOL:GLYCEROL MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
4od9 | [A2B2] | [A2B2] | [A4] | 1.9 | 2RZ:N-(3,4-DIMETHOXYBENZYL)-NALPHA-{N-[(3,4-DIMETHOXYPHENYL)ACETYL]CARBAMIMIDOYL}-D-PHENYLALANINAMIDE ACT:ACETATE ION NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
4pep | [A] | [A] | [A] | 1.8 | SEP:PHOSPHOSERINE | |||
4phv | [A2] | [A2] | [A2] | 2.1 | VAC:N,N-BIS(2-HYDROXY-1-INDANYL)-2,6- DIPHENYLMETHYL-4-HYDROXY-1,7-HEPTANDIAMIDE | |||
4pph | [A6] | [A6] | [A6] | 2.01 | EDO:1,2-ETHANEDIOL FUC:ALPHA-L-FUCOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
4pyv | [A] | [A] | [A] | 2.65 | 2XF:TERT-BUTYL {(3S,5R)-5-[CYCLOPROPYL(2,3-DICHLOROBENZYL)CARBAMOYL]PIPERIDIN-3-YL}CARBAMATE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4pzw | [A] | [A] | [A] | 1.8 | 2X4:(4R,4A___sq___S,10A___sq___S)-7___sq___-(5-CHLOROPYRIDIN-3-YL)-3___sq___,4___sq___,4A___sq___,10A___sq___-TETRAHYDRO-1___sq___H-SPIRO[1,3-OXAZOLE-4,5___sq___-PYRANO[3,4-B]CHROMEN]-2-AMINE NI:NICKEL (II) ION | |||
4pzx | [A] | [A] | [A] | 1.8 | 2X5:(4R,4A___sq___R,10A___sq___R)-7___sq___-(5-CHLOROPYRIDIN-3-YL)-3___sq___,4___sq___,4A___sq___,10A___sq___-TETRAHYDRO-1___sq___H-SPIRO[1,3-OXAZOLE-4,5___sq___-PYRANO[3,4-B]CHROMEN]-2-AMINE NI:NICKEL (II) ION | |||
4q1n | [A] | [A] | [A] | 2.09 | 2Y9:(3S,4R,5R)-N-CYCLOPROPYL-N___sq___-[(2R)-1-ETHOXY-4-METHYLPENTAN-2-YL]-4-HYDROXY-N-[5-(PROPAN-2-YL)PYRIDIN-2-YL]PIPERIDINE-3,5-DICARBOXAMIDE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE PO4:PHOSPHATE ION | |||
4q1w | [A2] | [A2] | [A2] | 1.85 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION PO4:PHOSPHATE ION | |||
4q1x | [A2] | [A2] | [A2] | 1.9 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE GOL:GLYCEROL PO4:PHOSPHATE ION | |||
4q1y | [A2] | [A2] | [A2] | 1.5 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE ACT:ACETATE ION PO4:PHOSPHATE ION | |||
4q5m | [A] | [A] | [A] | 1.8 | ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1 -PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
4qgi | [A2] | [A2] | [A2] | 1.9 | GOL:GLYCEROL ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
4qj2 | [A2][a] | [A2][a] | [A2][a] | 2.13 | GOL:GLYCEROL PO4:PHOSPHATE ION SO4:SULFATE ION | |||
4qj6 | [A2][a] | [A2][a] | [A2][a] | 1.5 | SO4:SULFATE ION | |||
4qj7 | [A2][a] | [A2][a] | [A2][a] | 1.67 | PO4:PHOSPHATE ION SO4:SULFATE ION | |||
4qj8 | [A2][a] | [A2][a] | [A2][a] | 2 | GOL:GLYCEROL PO4:PHOSPHATE ION | |||
4qj9 | [A2][a] | [A2][a] | [A2][a] | 1.83 | GOL:GLYCEROL PO4:PHOSPHATE ION | |||
4qja | [A2][a] | [A2][a] | [A2][a] | 1.54 | SO4:SULFATE ION | |||
4qlh | [A] | [A] | [A] | 2.45 | ||||
4r5n | [A] | [A] | [A] | 1.8 | 3J9:(4R,4A___sq___S,10A___sq___R)-8___sq___-(2-FLUOROPYRIDIN-3-YL)-4A___sq___-METHYL-3___sq___,4___sq___,4A___sq___,10A___sq___-TETRAHYDRO-2___sq___H-SPIRO[1,3-OXAZOLE-4,10___sq___-PYRANO[3,2-B]CHROMEN]-2-AMINE NI:NICKEL (II) ION | |||
4r8y | [A] | [A] | [A] | 1.9 | 3KO:(2E,5R)-5-(2-CYCLOHEXYLETHYL)-5-{[(3R)-1-(CYCLOPENTYLACETYL)PYRROLIDIN-3-YL]METHYL}-2-IMINO-3-METHYLIMIDAZOLIDIN-4-ONE TLA:L(+)-TARTARIC ACID | |||
4r91 | [A] | [A] | [A] | 1.58 | 3KT:(2E,5R)-5-(2-CYCLOHEXYLETHYL)-5-{[(1S,3R)-3-(CYCLOPENTYLAMINO)CYCLOHEXYL]METHYL}-2-IMINO-3-METHYLIMIDAZOLIDIN-4-ONE TLA:L(+)-TARTARIC ACID | |||
4r92 | [A] | [A] | [A] | 1.71 | 3KU:N-[(1R,3S)-3-{[(2E,4R)-4-(2-CYCLOHEXYLETHYL)-2-IMINO-1-METHYL-5-OXOIMIDAZOLIDIN-4-YL]METHYL}CYCLOHEXYL]PYRIDINE-4-CARBOXAMIDE TLA:L(+)-TARTARIC ACID | |||
4r93 | [A] | [A] | [A] | 1.71 | 779:1-[(1R,3S)-3-{[(2E,4R)-4-(2-CYCLOHEXYLETHYL)-2-IMINO-1-METHYL-5-OXOIMIDAZOLIDIN-4-YL]METHYL}CYCLOHEXYL]-3-PHENYLUREA TLA:L(+)-TARTARIC ACID | |||
4r95 | [A] | [A] | [A] | 1.99 | 3KW:(2E,5R)-5-(2-CYCLOHEXYLETHYL)-2-IMINO-3-METHYL-5-{[(1S,3R)-3-(QUINOLIN-2-YLAMINO)CYCLOHEXYL]METHYL}IMIDAZOLIDIN-4-ONE TLA:L(+)-TARTARIC ACID | |||
4rcd | [A] | [A] | [A] | 1.9 | 3LL:(5S)-7-(2-FLUOROPYRIDIN-3-YL)-3-[(3-METHYLOXETAN-3-YL)ETHYNYL]SPIRO[CHROMENO[2,3-B]PYRIDINE-5,4___sq___-[1,3]OXAZOL]-2___sq___-AMINE GOL:GLYCEROL IOD:IODIDE ION | |||
4rce | [A] | [A] | [A] | 2.4 | 3LN:(4S)-2___sq___-(2,2-DIMETHYLPROPOXY)-7___sq___-(PYRIMIDIN-5-YL)SPIRO[1,3-OXAZOLE-4,9___sq___-XANTHEN]-2-AMINE IOD:IODIDE ION | |||
4rcf | [A] | [A] | [A] | 1.78 | 3LO:(4S)-2___sq___-(3,6-DIHYDRO-2H-PYRAN-4-YL)-4___sq___-FLUORO-7___sq___-(2-FLUOROPYRIDIN-3-YL)SPIRO[1,3-OXAZOLE-4,9___sq___-XANTHEN]-2-AMINE GOL:GLYCEROL IOD:IODIDE ION | |||
4rgh | [A2] | [A2] | [A2] | 1.9 | CL:CHLORIDE ION | |||
4rld | [A] | [A] | [A] | 2.9 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE ZN:ZINC ION | |||
4rrn | [A] | [A] | [A] | 1.8 | 3UW:(4S,4A___sq___S,10A___sq___R)-2-AMINO-8___sq___-(2-FLUOROPYRIDIN-3-YL)-1-METHYL-3___sq___,4___sq___,4A___sq___,10A___sq___-TETRAHYDRO-2___sq___H-SPIRO[IMIDAZOLE-4,10___sq___-PYRANO[3,2-B]CHROMEN]-5(1H)-ONE NI:NICKEL (II) ION | |||
4rro | [A] | [A] | [A] | 1.8 | 3UX:(4S,4A___sq___R,10A___sq___S)-2-AMINO-8___sq___-(2-FLUOROPYRIDIN-3-YL)-1,4A___sq___-DIMETHYL-3___sq___,4___sq___,4A___sq___,10A___sq___-TETRAHYDRO-2___sq___H-SPIRO[IMIDAZOLE-4,10___sq___-PYRANO[3,2-B]CHROMEN]-5(1H)-ONE NI:NICKEL (II) ION | |||
4rrs | [A] | [A] | [A] | 1.8 | 3UY:(4R,4A___sq___R,10A___sq___S)-8___sq___-(2-FLUOROPYRIDIN-3-YL)-4A___sq___-METHYL-3___sq___,4___sq___,4A___sq___,10A___sq___-TETRAHYDRO-2___sq___H-SPIRO[1,3-OXAZOLE-4,10___sq___-PYRANO[3,2-B]CHROMEN]-2-AMINE NI:NICKEL (II) ION | |||
4rvi | [A2] | [A2] | [A2] | 1.99 | G52:(3R,3AS,3BR,6AS,7AS)-OCTAHYDRODIFURO[2,3-B:3___sq___,2___sq___-D]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}PROPYL]CARBAMATE | |||
4rvj | [A2] | [A2] | [A2] | 1.6 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER | |||
4rvx | [A2] | [A2] | [A2] | 1.96 | 79G:(4S)-4-AMINO-N-[(2S,3S)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]-3,4-DIHYDRO-2H-CHROMENE-6-CARBOXAMIDE | |||
4ryc | [A] | [A] | [A] | 2.45 | 3ZK:4-METHOXY-3-(3-METHOXYPROPOXY)-N-{[(3S,4S)-4-{[(4-METHYLPHENYL)SULFONYL]AMINO}PYRROLIDIN-3-YL]METHYL}-N-(PROPAN-2-YL)BENZAMIDE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4ryg | [A] | [A] | [A] | 2.65 | 3ZJ:N-({(3S,4S)-4-[(BENZYLSULFONYL)AMINO]PYRROLIDIN-3-YL}METHYL)-4-METHOXY-3-(3-METHOXYPROPOXY)-N-(PROPAN-2-YL)BENZAMIDE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4rz1 | [A] | [A] | [A] | 2.6 | 3ZN:(3S,4S)-4-({[4-METHOXY-3-(3-METHOXYPROPOXY)BENZOYL](PROPAN-2-YL)AMINO}METHYL)PYRROLIDIN-3-YLBENZYLCARBAMATE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
4s1g | [A] | [A] | [A] | 2.1 | 43T:3-{[(4S)-2-AMINO-4-METHYL-6-OXO-4-(PROPAN-2-YL)-5,6-DIHYDROPYRIMIDIN-1(4H)-YL]METHYL}-5-FLUORO-N-[(1S)-1-PHENYLETHYL]BENZAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
4trw | [A][a] | [A][a] | [A][a] | 2.85 | LHE:N-[(2R,3S)-3-AMINO-2-HYDROXY-5-METHYLHEXYL]-L-NORVALINE TIH:BETA(2-THIENYL)ALANINE | |||
4try | [A][a] | [A][a] | [A][a] | 2.75 | 36D:N-[(2R,3S)-3-AMINO-2-HYDROXY-4-(THIOPHEN-2-YL)BUTANOYL]-L-NORVALINE TIH:BETA(2-THIENYL)ALANINE | |||
4trz | [A][a] | [A][a] | [A][a] | 3.25 | TIH:BETA(2-THIENYL)ALANINE TVA:N-[(2R,3S)-3-AMINO-2-HYDROXY-4-(THIOPHEN-2-YL)BUTYL]-L-NORVALINE | |||
4tvg | [A2][a] | [A2][a] | [A2][a] | 2.18 | GOL:GLYCEROL IVA:ISOVALERIC ACID K97:3-(MORPHOLIN-4-YLMETHYL)-1H-INDOLE-6-CARBOXYLIC ACID STA:STATINE | |||
4tvh | [A2] | [A2] | [A2] | 2.2 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE BME:BETA-MERCAPTOETHANOL K97:3-(MORPHOLIN-4-YLMETHYL)-1H-INDOLE-6-CARBOXYLIC ACID | |||
4u7q | [A2] | [A2] | [A2] | 1.7 | 3EM:N~2~-({[7-(DIETHYLAMINO)-2-OXO-2H-CHROMEN-4-YL]METHOXY}CARBONYL)-N-[(2S,4S,5S)-4-HYDROXY-1,6-DIPHENYL-5-{[(1,3-THIAZOL-5-YLMETHOXY)CARBONYL]AMINO}HEXAN-2-YL]-L-VALINAMIDE | |||
4u7v | [A2] | [A2] | [A2] | 1.38 | 3EN:N-[(2S,4S,5S)-4-HYDROXY-1,6-DIPHENYL-5-{[(1,3-THIAZOL-5-YLMETHOXY)CARBONYL]AMINO}HEXAN-2-YL]-L-VALINAMIDE BME:BETA-MERCAPTOETHANOL | |||
4u8w | [A2] | [A2] | [A2] | 1.3 | ACT:ACETATE ION CL:CHLORIDE ION G10:(3R,3AS,6AS)-4,4-DIFLUOROHEXAHYDROFURO[2,3-B]FURAN-3-YL[(2S,3R)-4-{[(4-AMINOPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]CARBAMATE NA:SODIUM ION | |||
4upj | [A2] | [A2] | [A2] | 1.9 | U04:({3-[1-(4-HYDROXY-2-OXO-2H-CHROMEN-3-YL)-PROPYL]-PHENYLCARBAMOYL}-METHYL)-CARBAMIC ACID TERT-BUTYLESTER | |||
4wtu | [A] | [A] | [A] | 1.85 | 3UT:(5S)-3-(5,6-DIHYDRO-2H-PYRAN-3-YL)-1-FLUORO-7-(2-FLUOROPYRIDIN-3-YL)SPIRO[CHROMENO[2,3-C]PYRIDINE-5,4___sq___-[1,3]OXAZOL]-2___sq___-AMINE GOL:GLYCEROL IOD:IODIDE ION | |||
4wy1 | [A] | [A] | [A] | 1.98 | 3VO:(4AR,8AS)-8A-(2,4-DIFLUOROPHENYL)-4,4A,5,6,8,8A-HEXAHYDROPYRANO[3,4-D][1,3]THIAZIN-2-AMINE | |||
4wy6 | [A] | [A] | [A] | 2.1 | 3VP:(4AR,6R,8AS)-8A-(2,4-DIFLUOROPHENYL)-6-(FLUOROMETHYL)-4,4A,5,6,8,8A-HEXAHYDROPYRANO[3,4-D][1,3]THIAZIN-2-AMINE DMS:DIMETHYL SULFOXIDE IOD:IODIDE ION | |||
4x2l | [A] | [A] | [A] | 2.55 | 3WP:(4S)-4-(2,4-DIFLUOROPHENYL)-4-METHYL-5,6-DIHYDRO-4H-1,3-THIAZIN-2-AMINE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL IOD:IODIDE ION NA:SODIUM ION | |||
4x7i | [A] | [A] | [A] | 1.77 | 3YS:N-{3-[(4AS,7AS)-2-AMINO-4A,5-DIHYDRO-4H-FURO[3,4-D][1,3]THIAZIN-7A(7H)-YL]-4-FLUOROPHENYL}-5-FLUOROPYRIDINE-2-CARBOXAMIDE GOL:GLYCEROL | |||
4xkx | [A] | [A] | [A] | 1.8 | 43K:(5S)-7-(2-FLUOROPYRIDIN-3-YL)-3-(2-FLUOROPYRIDIN-4-YL)SPIRO[CHROMENO[2,3-C]PYRIDINE-5,4___sq___-[1,3]OXAZOL]-2___sq___-AMINE GOL:GLYCEROL IOD:IODIDE ION | |||
4xx3 | [A] | [A] | [A] | 2.4 | 70X:N-BENZYL-3-{[(2Z,4S)-2-IMINO-4-METHYL-6-OXO-4-(PROPAN-2-YL)TETRAHYDROPYRIMIDIN-1(2H)-YL]METHYL}BENZAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
4xx4 | [A] | [A] | [A] | 2.4 | 70Y:(2Z,6S)-2-IMINO-6-METHYL-3-{3-[(4R)-2-OXO-4-PHENYLPYRROLIDIN-1-YL]BENZYL}-6-(PROPAN-2-YL)TETRAHYDROPYRIMIDIN-4(1H)-ONE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
4xxs | [A] | [A] | [A] | 1.86 | DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL IOD:IODIDE ION SI5:(4AR,6R,8AS)-8A-(2,4-DIFLUOROPHENYL)-6-(1-METHYL-1H-PYRAZOL-4-YL)-4,4A,5,6,8,8A-HEXAHYDROPYRANO[3,4-D][1,3]THIAZIN-2-AMINE | |||
4y35 | [A] | [A] | [A] | 1.46 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE F90:4-CHLOROBENZYL CARBAMIMIDOTHIOATE GOL:GLYCEROL | |||
4y36 | [A] | [A] | [A] | 1.59 | 45L:3-METHYLBENZOHYDRAZIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL PGE:TRIETHYLENE GLYCOL | |||
4y37 | [A] | [A] | [A] | 1.69 | 45J:4-CHLORO-2-METHYLTHIENO[2,3-D][1,2,3]DIAZABORININ-1(2H)-OL ACT:ACETATE ION GOL:GLYCEROL | |||
4y38 | [A] | [A] | [A] | 1.1 | 0A9:METHYL L-PHENYLALANINATE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4y39 | [A] | [A] | [A] | 1.2 | 45M:4-BROMO-N___sq___-(3,4-DIHYDRO-2H-PYRROL-5-YL)BENZOHYDRAZIDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL PEG:DI(HYDROXYETHYL)ETHER | |||
4y3a | [A] | [A] | [A] | 1.17 | 45O:6-{[(3R,5S)-3,5-DIMETHYLPIPERIDIN-1-YL]METHYL}-N,N-DIMETHYL-1,3,5-TRIAZINE-2,4-DIAMINE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y3d | [A] | [A] | [A] | 1.48 | 45N:N-(1,3-BENZODIOXOL-5-YLMETHYL)CYCLOPENTANAMINE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4y3e | [A] | [A] | [A] | 1.25 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE F05:1H-ISOINDOL-3-AMINE GOL:GLYCEROL PGE:TRIETHYLENE GLYCOL | |||
4y3f | [A] | [A] | [A] | 1.4 | 78B:ETHYL 4-(AMINOMETHYL)BENZOATE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y3g | [A] | [A] | [A] | 1.13 | 463:N-[3-(AMINOMETHYL)PHENYL]ACETAMIDE GOL:GLYCEROL | |||
4y3h | [A] | [A] | [A] | 1.23 | 45X:2-(PYRIDIN-3-YL)ETHANAMINE ACT:ACETATE ION GOL:GLYCEROL | |||
4y3j | [A] | [A] | [A] | 1.31 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL HIC:4-METHYL-HISTIDINE | |||
4y3l | [A] | [A] | [A] | 1.16 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL TP5:THIOPHENE-3-CARBOXIMIDAMIDE | |||
4y3m | [A] | [A] | [A] | 1.55 | 45Y:2-(4-FLUOROPHENYL)ACETOHYDRAZIDE ACT:ACETATE ION GOL:GLYCEROL PEG:DI(HYDROXYETHYL)ETHER PGE:TRIETHYLENE GLYCOL | |||
4y3n | [A] | [A] | [A] | 1.34 | 45V:2-[(1S)-2-ACETYL-1,2-DIHYDROISOQUINOLIN-1-YL]-N,N-DIMETHYLACETAMIDE ACT:ACETATE ION GOL:GLYCEROL | |||
4y3p | [A] | [A] | [A] | 1.55 | 46S:1-(6-METHYLPYRIMIDIN-4-YL)AZEPANE GOL:GLYCEROL | |||
4y3q | [A] | [A] | [A] | 1.17 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE F02:4-(DIETHYLAMINO)BENZOHYDRAZIDE GOL:GLYCEROL PEG:DI(HYDROXYETHYL)ETHER PGE:TRIETHYLENE GLYCOL | |||
4y3r | [A] | [A] | [A] | 1.13 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE F06:2-CHLOROBENZYL CARBAMIMIDOTHIOATE GOL:GLYCEROL | |||
4y3s | [A] | [A] | [A] | 1.1 | 46L:6-(DIMETHYLAMINO)PYRIDINE-3-CARBOXYLIC ACID ACT:ACETATE ION GOL:GLYCEROL | |||
4y3t | [A] | [A] | [A] | 1.42 | 46H:(3S)-PIPERIDIN-3-YL(PIPERIDIN-1-YL)METHANONE 46J:(3R)-PIPERIDIN-3-YL(PIPERIDIN-1-YL)METHANONE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4y3w | [A] | [A] | [A] | 1.58 | 46Q:(2R)-2-METHYL-2-(MORPHOLIN-4-YL)BUTAN-1-AMINE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y3x | [A] | [A] | [A] | 1.25 | 46P:4-METHYL-5-(1-METHYL-1H-IMIDAZOL-2-YL)-1,3-THIAZOL-2-AMINE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4y3y | [A] | [A] | [A] | 1.35 | ACT:ACETATE ION DCL:2-AMINO-4-METHYL-PENTAN-1-OL DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4y3z | [A] | [A] | [A] | 1.12 | ACT:ACETATE ION EDO:1,2-ETHANEDIOL F41:N-(1,3-BENZODIOXOL-5-YL)-2-(PIPERIDIN-1-YL)ACETAMIDE GOL:GLYCEROL | |||
4y41 | [A] | [A] | [A] | 1.4 | 46O:(2R)-2-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)PYRROLIDINE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y43 | [A] | [A] | [A] | 1.48 | 46T:(1E,2E)-N,N___sq___-DI(PROPAN-2-YL)CYCLOHEPTA-3,5-DIENE-1,2-DIIMINE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y44 | [A] | [A] | [A] | 1.24 | 46Y:4,6-DIMETHYL-2-{[3-(MORPHOLIN-4-YL)PROPYL]AMINO}PYRIDINE-3-CARBONITRILE ACT:ACETATE ION GOL:GLYCEROL | |||
4y45 | [A] | [A] | [A] | 1.06 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE F91:N-(PYRIDIN-4-YLMETHYL)-2,3-DIHYDRO-1,4-BENZODIOXIN-6-AMINE GOL:GLYCEROL | |||
4y47 | [A] | [A] | [A] | 1.19 | 479:4-OXO-N-[(1S)-1-(PYRIDIN-3-YL)ETHYL]-4-(THIOPHEN-2-YL)BUTANAMIDE ACT:ACETATE ION GOL:GLYCEROL | |||
4y48 | [A] | [A] | [A] | 1.25 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GLY:GLYCINE GOL:GLYCEROL PRO:PROLINE | |||
4y4a | [A] | [A] | [A] | 1.28 | 47G:5-(AMINOMETHYL)-2-METHOXYPHENOL ACT:ACETATE ION GOL:GLYCEROL | |||
4y4b | [A] | [A] | [A] | 1.11 | 47H:6,6,8-TRIMETHYL-5,6-DIHYDRO[1,3]DIOXOLO[4,5-G]QUINOLINE ACT:ACETATE ION GOL:GLYCEROL PGE:TRIETHYLENE GLYCOL | |||
4y4d | [A] | [A] | [A] | 1.27 | ACT:ACETATE ION CFF:CAFFEINE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4y4e | [A] | [A] | [A] | 1.3 | 46R:5-METHYL-~{N}-[2,2,2-TRIS(FLUORANYL)ETHYL]-1,2-OXAZOLE-3-CARBOXAMIDE ACT:ACETATE ION GOL:GLYCEROL PGE:TRIETHYLENE GLYCOL | |||
4y4g | [A] | [A] | [A] | 1.44 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GGB:L-CANAVANINE GOL:GLYCEROL | |||
4y4j | [A] | [A] | [A] | 1.03 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL LNR:L-NOREPINEPHRINE | |||
4y4t | [A] | [A] | [A] | 1.3 | 46X:3-AMINO-5-(PYRROLIDIN-1-YL)-1H-PYRAZOLE-4-CARBONITRILE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL PEG:DI(HYDROXYETHYL)ETHER | |||
4y4u | [A] | [A] | [A] | 1.75 | 46V:1-(4-BROMO-2-CHLOROPHENYL)-3-METHYLTHIOUREA GOL:GLYCEROL PEG:DI(HYDROXYETHYL)ETHER PGE:TRIETHYLENE GLYCOL | |||
4y4w | [A] | [A] | [A] | 1.45 | 46W:4-METHYLPIPERIDINE-1-CARBOXIMIDAMIDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL PEG:DI(HYDROXYETHYL)ETHER SO4:SULFATE ION | |||
4y4x | [A] | [A] | [A] | 1.67 | 47Q:5-[(PYRIDIN-2-YLMETHYL)AMINO]-1,3-DIHYDRO-2H-BENZIMIDAZOL-2-ONE DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y4z | [A] | [A] | [A] | 1.48 | 47R:(1Z)-N,N-DIETHYLETHANIMIDAMIDE ACT:ACETATE ION EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y50 | [A] | [A] | [A] | 1.32 | 47S:3-(DIMETHYLAMINO)BENZOHYDRAZIDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL PGE:TRIETHYLENE GLYCOL | |||
4y51 | [A] | [A] | [A] | 1.6 | 47A:2-AMINO-1-(4-BROMOPHENYL)ETHANONE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y53 | [A] | [A] | [A] | 1.62 | 47B:3-(3,4-DIFLUOROPHENYL)IMIDAZO[2,1-C][1,2,4]TRIAZINE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y54 | [A] | [A] | [A] | 1.61 | 47E:(2R)-(3-CHLOROPHENYL)(HYDROXY)ETHANOIC ACID ACT:ACETATE ION EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y56 | [A] | [A] | [A] | 1.63 | 47J:1-(1,3-DIMETHYL-1H-PYRAZOL-5-YL)METHANAMINE DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y57 | [A] | [A] | [A] | 1.49 | ACT:ACETATE ION EDO:1,2-ETHANEDIOL F63:N-METHYL-1-[5-(PYRIDIN-3-YLOXY)FURAN-2-YL]METHANAMINE GOL:GLYCEROL | |||
4y58 | [A] | [A] | [A] | 1.17 | 47L:N-[(2R)-TETRAHYDROFURAN-2-YLMETHYL]CYCLOHEXANECARBOXAMIDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE PEG:DI(HYDROXYETHYL)ETHER PG4:TETRAETHYLENE GLYCOL | |||
4y5a | [A] | [A] | [A] | 1.45 | 47M:1-[5-(TRIFLUOROMETHYL)FURAN-2-YL]METHANAMINE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y5b | [A] | [A] | [A] | 1.24 | 47P:2-({[(1S)-1-CYCLOPROPYLETHYL](METHYL)AMINO}METHYL)QUINAZOLIN-4(3H)-ONE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4y5c | [A] | [A] | [A] | 1.19 | 47V:2,5-DIMETHYL-N-(PYRIDIN-4-YL)FURAN-3-CARBOXAMIDE ACT:ACETATE ION GOL:GLYCEROL | |||
4y5e | [A] | [A] | [A] | 1.12 | 47T:(2R)-N-(TRANS-4-METHYLCYCLOHEXYL)TETRAHYDROFURAN-2-CARBOXAMIDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4y5g | [A] | [A] | [A] | 1.47 | 47U:N-(PYRIDIN-2-YL)-2-(1,3,5-TRIMETHYL-1H-PYRAZOL-4-YL)ACETAMIDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4y5k | [A] | [A] | [A] | 1.44 | 489:(1S)-2-AMINO-1-(4-FLUOROPHENYL)ETHANOL ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4y5l | [A] | [A] | [A] | 0.99 | ACT:ACETATE ION GOL:GLYCEROL NA:SODIUM ION PEG:DI(HYDROXYETHYL)ETHER PG4:TETRAETHYLENE GLYCOL PGE:TRIETHYLENE GLYCOL | |||
4y5m | [A] | [A] | [A] | 1.28 | 47Y:3-[(4E)-4-IMINO-5,6-DIMETHYLFURO[2,3-D]PYRIMIDIN-3(4H)-YL]-N,N-DIMETHYLPROPAN-1-AMINE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4y5n | [A] | [A] | [A] | 1.29 | 487:6-[(1S)-1-(AZEPAN-1-YL)ETHYL]-N,N-DIMETHYL-1,3,5-TRIAZINE-2,4-DIAMINE ACT:ACETATE ION EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4y5p | [A] | [A] | [A] | 1.23 | 483:2-(1H-IMIDAZOL-1-YL)-N-(TRANS-4-METHYLCYCLOHEXYL)ACETAMIDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4y6m | [A] | [A] | [A] | 2.27 | 48Q:~{N}1-[(~{Z},3~{R})-4-[2-(3-METHOXYPHENYL)PROPAN-2-YLAMINO]-3-OXIDANYL-1-PHENYL-BUT-1-EN-2-YL]-5-PIPERIDIN-1-YL-~{N}3,~{N}3-DIPROPYL-BENZENE-1,3-DICARBOXAMIDE GOL:GLYCEROL | |||
4y9w | [A][a] | [A][a] | [A][a] | 0.83 | IVA:ISOVALERIC ACID STA:STATINE | |||
4ya8 | [A] | [A] | [A] | 3.3 | 49W:N___sq___-[(2S,3S)-3-HYDROXY-1-PHENYL-4-{[2-(PYRIDIN-2-YL)PROPAN-2-YL]AMINO}BUTAN-2-YL]-N,N-DIPROPYL-5-(PYRIDIN-1(2H)-YL)BENZENE-1,3-DICARBOXAMIDE GOL:GLYCEROL | |||
4ybf | [A] | [A] | [A] | 1.24 | PEG:DI(HYDROXYETHYL)ETHER | |||
4ybi | [A] | [A] | [A] | 1.84 | 4B2:(4S)-4-[2,4-DIFLUORO-5-(PYRIMIDIN-5-YL)PHENYL]-4-METHYL-5,6-DIHYDRO-4H-1,3-THIAZIN-2-AMINE GOL:GLYCEROL | |||
4yck | [A] | [A] | [A] | 1.07 | 78B:ETHYL 4-(AMINOMETHYL)BENZOATE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4yct | [A] | [A] | [A] | 1.13 | ACT:ACETATE ION EDO:1,2-ETHANEDIOL FBF:4-(TRIFLUOROMETHYL)BENZENECARBOXIMIDAMIDE GOL:GLYCEROL PEG:DI(HYDROXYETHYL)ETHER | |||
4ycy | [A] | [A] | [A] | 1.7 | 4AO:2-(4-ETHOXY-8-METHYLQUINAZOLIN-2-YL)GUANIDINE GOL:GLYCEROL PEG:DI(HYDROXYETHYL)ETHER | |||
4yd3 | [A] | [A] | [A] | 1.25 | 1PE:PENTAETHYLENE GLYCOL 4AQ:2-(1H-INDOL-3-YL)-N-[(1-METHYL-1H-PYRROL-2-YL)METHYL]ETHANAMINE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PEG:DI(HYDROXYETHYL)ETHER | |||
4yd4 | [A] | [A] | [A] | 1.27 | 4AY:4-(BROMOMETHYL)BENZOIC ACID BR:BROMIDE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL PG4:TETRAETHYLENE GLYCOL | |||
4yd5 | [A] | [A] | [A] | 1.21 | 4AV:1-(2-CHLORO-5-NITROPHENYL)-N-METHYLMETHANAMINE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
4yd6 | [A] | [A] | [A] | 1.3 | 4AS:N-METHYL-1-(1-METHYL-1H-IMIDAZOL-2-YL)METHANAMINE ACT:ACETATE ION EDO:1,2-ETHANEDIOL GOL:GLYCEROL PEG:DI(HYDROXYETHYL)ETHER PGE:TRIETHYLENE GLYCOL | |||
4yd7 | [A] | [A] | [A] | 1.42 | ACT:ACETATE ION F5N:2-(IMIDAZO[1,2-A]PYRIDIN-2-YL)-N-PHENYLACETAMIDE GOL:GLYCEROL PG4:TETRAETHYLENE GLYCOL PGE:TRIETHYLENE GLYCOL | |||
4ydf | [A2] | [A2] | [A2] | 2.8 | 4B1:N-BENZYL-N-[(3S,4S)-4-{BENZYL[(4-NITROPHENYL)SULFONYL]AMINO}PYRROLIDIN-3-YL]-3-NITROBENZENESULFONAMIDE SO4:SULFATE ION | |||
4ydg | [A2] | [A2] | [A2] | 3.25 | G3G:N,N___sq___-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-AMINO-N-BENZYLBENZENESULFONAMIDE) SO4:SULFATE ION | |||
4ye3 | [A2] | [A2] | [A2] | 1.35 | CL:CHLORIDE ION G04:(3R,3AS,4R,6AR)-4-METHOXYHEXAHYDROFURO[2,3-B]FURAN-3-YL[(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE GOL:GLYCEROL Y1:YTTRIUM ION | |||
4yhq | [A2] | [A2] | [A2] | 1.3 | CL:CHLORIDE ION G10:(3R,3AS,6AS)-4,4-DIFLUOROHEXAHYDROFURO[2,3-B]FURAN-3-YL[(2S,3R)-4-{[(4-AMINOPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]CARBAMATE GOL:GLYCEROL NA:SODIUM ION Y1:YTTRIUM ION | |||
4yoa | [A2] | [A2] | [A2] | 1.7 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
4yob | [A2] | [A2] | [A2] | 1.5 | ||||
4z22 | [A] | [A] | [A] | 2.62 | 4KG:2-AMINO-7-PHENYL-3-{[(2R,5S)-5-PHENYLTETRAHYDROFURAN-2-YL]METHYL}QUINAZOLIN-4(3H)-ONE | |||
4z2z | [A2] | [A2] | [A2] | 1.8 | ||||
4z4x | [A2] | [A2] | [A2] | 1.75 | ||||
4z50 | [A2] | [A2] | [A2] | 1.45 | CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
4ze6 | [A] | [A] | [A] | 1.17 | 011:7-AMINOHEPTANOIC ACID ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
4zea | [A] | [A] | [A] | 1.2 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL IMI:2-IMINOBIOTIN | |||
4zip | [A2] | [A2] | [A2] | 1.11 | CL:CHLORIDE ION G64:N-[(2,5-DIMETHYL-1,3-OXAZOL-4-YL)METHYL]-N___sq___-[(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]-N,5-DIMETHYLBENZENE-1,3-DICARBOXAMIDE GOL:GLYCEROL NA:SODIUM ION | |||
4zls | [A2] | [A2] | [A2] | 1.53 | ACT:ACETATE ION CL:CHLORIDE ION G61:TERT-BUTYL [(2S,3R)-1-(3___sq___,5___sq___-DIMETHOXYBIPHENYL-3-YL)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}BUTAN-2-YL]CARBAMATE NA:SODIUM ION | |||
4zpe | [A] | [A] | [A] | 1.7 | 4QA:4-(CYCLOHEXYLAMINO)-1-(3-FLUOROPHENYL)-8-[3-(PROPAN-2-YLOXY)BENZYL]-1,3,8-TRIAZASPIRO[4.5]DEC-3-EN-2-ONE | |||
4zpf | [A] | [A] | [A] | 1.8 | 4QD:8-(3-{[(2S)-1-AMINOPROPAN-2-YL]OXY}BENZYL)-4-(CYCLOHEXYLAMINO)-1-(3-FLUOROPHENYL)-1,3,8-TRIAZASPIRO[4.5]DEC-3-EN-2-ONE | |||
4zpg | [A] | [A] | [A] | 2 | 4QF:(5R,7S)-8-BENZYL-4-(CYCLOHEXYLAMINO)-1-(3-FLUOROPHENYL)-7-METHYL-1,3,8-TRIAZASPIRO[4.5]DEC-3-EN-2-ONE | |||
4zsm | [A] | [A] | [A] | 1.96 | 4RW:(4AS,8AR)-4A,5,6,7,8,8A-HEXAHYDRO-4H-3,1-BENZOTHIAZIN-2-AMINE GOL:GLYCEROL | |||
4zsp | [A] | [A] | [A] | 1.91 | 4RZ:N-[(4AS,6S,8AR)-2-AMINO-4A,5,6,7,8,8A-HEXAHYDRO-4H-3,1-BENZOTHIAZIN-6-YL]-3-CHLOROBENZAMIDE GOL:GLYCEROL | |||
4zsq | [A] | [A] | [A] | 2.3 | 4RX:N-[(4S,4AS,6S,8AR)-10-AMINOHEXAHYDRO-3H-4,8A-(EPITHIOMETHENOAZENO)ISOCHROMEN-6(1H)-YL]-3-CHLOROBENZAMIDE GOL:GLYCEROL | |||
4zsr | [A] | [A] | [A] | 1.65 | 4RY:N-[(4AS,6S,8AR)-2-AMINO-5,6,7,8-TETRAHYDRO-4A,8A-(METHANOOXYMETHANO)-3,1-BENZOTHIAZIN-6(4H)-YL]-3-CHLOROBENZAMIDE | |||
5agz | [A2] | [A2] | [A2] | 1.2 | CL:CHLORIDE ION QHA:(3R,3AS,4R,6AR)-4-[(2-FLUOROPROP-2-EN-1-YL)OXY]HEXAHYDROFURO[2,3-B]FURAN-3-YL {(2S,3R)-3-HYDROXY-4-[{[2-(METHYLAMINO)-1,3-BENZOXAZOL-6-YL]SULFONYL}(2-METHYLPROPYL)AMINO]-1-PHENYLBUTAN-2-YL}CARBAMATE | |||
5ah6 | [A2] | [A2] | [A2] | 1.5 | C7U:(3R,3AS,4R,6AS)-4-CHLOROHEXAHYDROFURO[2,3-B]FURAN-3-YL{(2S,3R)-3-HYDROXY-4-[{[2-(METHYLAMINO)-1,3-BENZOXAZOL-6-YL]SULFONYL}(2-METHYLPROPYL)AMINO]-1-PHENYLBUTAN-2-YL}CARBAMATE CL:CHLORIDE ION | |||
5ah7 | [A2] | [A2] | [A2] | 1.55 | C7J:(3R,3AS,4R,6AS)-4-CHLOROHEXAHYDROFURO[2,3-B]FURAN-3-YL[(2S,3R)-4-{[(4-AMINOPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]CARBAMATE CL:CHLORIDE ION | |||
5ah8 | [A2] | [A2] | [A2] | 1.26 | C7W:(3R,3AS,4R,6AR)-4-(3,3,3-TRIFLUOROPROPOXY)HEXAHYDROFURO[2,3-B]FURAN-3-YL {(2S,3R)-3-HYDROXY-4-[{[2-(METHYLAMINO)-1,3-BENZOXAZOL-6-YL]SULFONYL}(2-METHYLPROPYL)AMINO]-1-PHENYLBUTAN-2-YL}CARBAMATE CL:CHLORIDE ION | |||
5ah9 | [A2] | [A2] | [A2] | 1.44 | C7L:(3R,3AS,4R,6AR)-4-(2-METHOXYETHOXY)HEXAHYDROFURO[2,3-B]FURAN-3-YL [(2S,3R)-4-{[(4-AMINOPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]CARBAMATE CL:CHLORIDE ION | |||
5aha | [A2] | [A2] | [A2] | 1.35 | CL:CHLORIDE ION ZLP:(3R,3AS,4R,6AR)-4-(2-METHOXYETHOXY)HEXAHYDROFURO[2,3-B]FURAN-3-YL {(2S,3R)-3-HYDROXY-4-[{[(2Z)-2-(METHYLIMINO)-2,3-DIHYDRO-1,3-BENZOXAZOL-6-YL]SULFONYL}(2-METHYLPROPYL)AMINO]-1-PHENYLBUTAN-2-YL}CARBAMATE | |||
5ahb | [A2] | [A2] | [A2] | 1.5 | CL:CHLORIDE ION J5L:(3R,3AS,4R,6AR)-4-[2-(METHYLAMINO)-2-OXOETHOXY]HEXAHYDROFURO[2,3-B]FURAN-3-YL {(2S,3R)-3-HYDROXY-4-[{[(2Z)-2-(METHYLIMINO)-2,3-DIHYDRO-1,3-BENZOXAZOL-6-YL]SULFONYL}(2-METHYLPROPYL)AMINO]-1-PHENYLBUTAN-2-YL}CARBAMATE | |||
5ahc | [A2] | [A2] | [A2] | 1.5 | CL:CHLORIDE ION VXL:(3R,3AS,4R,6AR)-4-[2-(METHYLAMINO)-2-OXOETHOXY]HEXAHYDROFURO[2,3-B]FURAN-3-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE | |||
5apr | [A][a] | [A][a] | [A][a] | 2.1 | CA:CALCIUM ION DHL:2-AMINO-ETHANETHIOL STA:STATINE | |||
5b18 | [A2] | [A2] | [A2] | 1.8 | ACT:ACETATE ION CL:CHLORIDE ION | |||
5bry | [A2] | [A2] | [A2] | 1.34 | 4UY:(3R,3AS,4R,6AR)-4-(METHYLAMINO)HEXAHYDROFURO[2,3-B]FURAN-3-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE CL:CHLORIDE ION NA:SODIUM ION | |||
5bs4 | [A2] | [A2] | [A2] | 1.29 | 4UX:(3R,3AS,4R,6AR)-4-(METHYLAMINO)HEXAHYDROFURO[2,3-B]FURAN-3-YL [(2S,3R)-4-{[(4-AMINOPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]CARBAMATE ACT:ACETATE ION CL:CHLORIDE ION NA:SODIUM ION | |||
5bwy | [A] | [A] | [A] | 2.64 | ||||
5c9b | [A4] | [A4] | [A4] | 2.4 | MSE:SELENOMETHIONINE | |||
5c9d | [A2] | [A2] | [A2] | 2.59 | NA:SODIUM ION | |||
5c9f | [A4] | [A4] | [A4] | 2 | CL:CHLORIDE ION NA:SODIUM ION | |||
5clm | [A] | [A] | [A] | 2.61 | 52K:N-{3-[(3R)-5-AMINO-3-METHYL-3,6-DIHYDRO-2H-1,4-OXAZIN-3-YL]PHENYL}-5-CHLOROPYRIDINE-2-CARBOXAMIDE CL:CHLORIDE ION IOD:IODIDE ION | |||
5cok | [A2] | [A2] | [A2] | 1.8 | 52U:(3AS,4S,7AR)-HEXAHYDRO-4H-FURO[2,3-B]PYRAN-4-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE | |||
5con | [A2] | [A2] | [A2] | 1.8 | 52W:(3R,3AS,4S,7AS)-3-HYDROXYHEXAHYDRO-4H-FURO[2,3-B]PYRAN-4-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE | |||
5coo | [A2] | [A2] | [A2] | 1.8 | 52Z:(3R,3AS,4S,7AS)-3-HYDROXYHEXAHYDRO-4H-FURO[2,3-B]PYRAN-4-YL [(2S,3R)-3-HYDROXY-1-(4-METHOXYPHENYL)-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}BUTAN-2-YL]CARBAMATE | |||
5cop | [A2] | [A2] | [A2] | 2 | 53F:(3R,3AS,4S,7AS)-3-HYDROXYHEXAHYDRO-4H-FURO[2,3-B]PYRAN-4-YL [(2S,3R)-4-{[(4-AMINOPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-3-HYDROXY-1-(4-METHOXYPHENYL)BUTAN-2-YL]CARBAMATE | |||
5dgu | [A2] | [A2] | [A2] | 1.22 | 5B7:(3R,3AR,4S,7AS)-3-METHOXYHEXAHYDRO-4H-FURO[2,3-B]PYRAN-4-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE ACT:ACETATE ION CL:CHLORIDE ION NA:SODIUM ION | |||
5dgw | [A2] | [A2] | [A2] | 1.62 | 5B5:(3R,3AS,4S,7AS)-3-(ETHYLAMINO)HEXAHYDRO-4H-FURO[2,3-B]PYRAN-4-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE CL:CHLORIDE ION NA:SODIUM ION | |||
5dpz | [A] | [A] | [A] | 1.33 | 1PE:PENTAETHYLENE GLYCOL 51V:2-METHYLANILINE ACT:ACETATE ION GOL:GLYCEROL PEG:DI(HYDROXYETHYL)ETHER | |||
5dq1 | [A] | [A] | [A] | 1.49 | 5HL:3-[(CYCLOPROPYLAMINO)METHYL]-8-ETHYLQUINOLIN-2(1H)-ONE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
5dq2 | [A] | [A] | [A] | 1.51 | 5HO:N-(5-CHLOROPYRIDIN-2-YL)-2-OXO-2-(PYRROLIDIN-1-YL)ACETAMIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
5dq4 | [A] | [A] | [A] | 1.15 | 5HQ:1-[6-(FURAN-2-YL)PYRIDIN-3-YL]METHANAMINE GOL:GLYCEROL | |||
5dq5 | [A] | [A] | [A] | 1.47 | 5HS:3-[2-(4-METHYL-1,2-OXAZOL-3-YL)ETHYL]PYRIDINE ACT:ACETATE ION GOL:GLYCEROL | |||
5dqc | [A] | [A] | [A] | 2.47 | 5E7:N-[(2S,3R)-3-HYDROXY-4-({(2S,3S)-3-HYDROXY-1-[(2-METHYLPROPYL)AMINO]-1-OXOBUTAN-2-YL}AMINO)-1-PHENYLBUTAN-2-YL]-5-[METHYL(METHYLSULFONYL)AMINO]-N___sq___-[(1R)-1-PHENYLETHYL]BENZENE-1,3-DICARBOXAMIDE | |||
5dr0 | [A] | [A] | [A] | 1.4 | 5GC:5-(METHYLSULFANYL)-4-(PROPAN-2-YLSULFONYL)-1H-PYRAZOL-3-AMINE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
5dr1 | [A] | [A] | [A] | 1.45 | 5GJ:[(3R)-3-HYDROXYPIPERIDIN-1-YL](1-PHENYLCYCLOPROPYL)METHANONE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
5dr3 | [A] | [A] | [A] | 1.24 | 5GL:4-PROPAN-2-YLSULFANYL-1-PROPYL-6,7-DIHYDRO-5~{H}-CYCLOPENTA[D]PYRIMIDIN-2-ONE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
5dr4 | [A] | [A] | [A] | 1.5 | 5GQ:7-METHYL-3,4-DIHYDRO-2~{H}-PYRIDO[1,2-A]PYRIMIDIN-3-OL ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PG4:TETRAETHYLENE GLYCOL | |||
5dr7 | [A] | [A] | [A] | 1.23 | 5HJ:(2R)-3-CYCLOPROPYL-2-(4-METHOXYPHENYL)-1,3-THIAZOLIDIN-4-ONE ACT:ACETATE ION GOL:GLYCEROL PGE:TRIETHYLENE GLYCOL | |||
5dr8 | [A] | [A] | [A] | 1.47 | 5G1:2-CHLOROBENZOHYDRAZIDE ACT:ACETATE ION GOL:GLYCEROL PGE:TRIETHYLENE GLYCOL | |||
5e5j | [A2] | [A2] | [A2] | 1.85 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
5e5k | [A2] | [A2] | [A2] | 1.75 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
5enk | [A] | [A] | [A] | 2.11 | 5QV:(4~{S},6~{S})-4-[2,4-BIS(FLUORANYL)-5-PYRIMIDIN-5-YL-PHENYL]-6-(3,5-DIMETHYL-1,2-OXAZOL-4-YL)-4-METHYL-5,6-DIHYDRO-1,3-THIAZIN-2-AMINE GOL:GLYCEROL IOD:IODIDE ION | |||
5enm | [A] | [A] | [A] | 1.98 | 5QU:(2~{R},4~{S},6~{S})-4-[2,4-BIS(FLUORANYL)-5-PYRIMIDIN-5-YL-PHENYL]-6-(3,5-DIMETHYL-1,2-OXAZOL-4-YL)-1,3-THIAZINAN-2-AMINE GOL:GLYCEROL IOD:IODIDE ION | |||
5er1 | [A] | [A] | [A] | 2 | 0HT:METHYL N-[(2S,3S)-3-AMINO-2-HYDROXY-5-METHYLHEXYL]-L-VALYL-L-ISOLEUCYL-L-PHENYLALANINATE | |||
5er2 | [A] | [A] | [A] | 1.8 | 0EK:6-AMMONIO-N-{[(2R,3R)-3-{[N-(TERT-BUTOXYCARBONYL)-L-PHENYLALANYL-3-(1H-IMIDAZOL-3-IUM-4-YL)-L-ALANYL]AMINO}-4-CYCLOHEXYL-2-HYDROXYBUTYL](2-METHYLPROPYL)CARBAMOYL}-L-NORLEUCYL-L-PHENYLALANINE | |||
5ezx | [A] | [A] | [A] | 1.9 | 5T5:[(1~{R},2~{R})-2-[(4~{S})-2-AZANYL-4-[4-[BIS(FLUORANYL)METHOXY]PHENYL]-5~{H}-1,3-OXAZOL-4-YL]CYCLOPROPYL]-(5-CHLORANYLPYRIDIN-3-YL)METHANONE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
5ezz | [A] | [A] | [A] | 2.1 | 5T6:(4~{S})-4-[4-[BIS(FLUORANYL)METHOXY]-3-METHYL-PHENYL]-4-[3-(5-CHLORANYLPYRIDIN-3-YL)PHENYL]-5~{H}-1,3-OXAZOL-2-AMINE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
5f00 | [A] | [A] | [A] | 1.95 | 5T8:(5~{R})-5-[3-[(3-CHLORANYLQUINOLIN-8-YL)AMINO]PHENYL]-5-METHYL-2,6-DIHYDRO-1,4-OXAZIN-3-AMINE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
5f01 | [A] | [A] | [A] | 1.52 | 5T7:(1~{R},2~{R})-2-[(4~{R})-2-AZANYL-5,5-BIS(FLUORANYL)-4-METHYL-6~{H}-1,3-OXAZIN-4-YL]-~{N}-(3-CHLORANYLQUINOLIN-8-YL)CYCLOPROPANE-1-CARBOXAMIDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL NA:SODIUM ION | |||
5fiv | [A2] | [A2] | [A2] | 1.9 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE | |||
5hco | [A] | [A] | [A] | 1.17 | 601:4-(DIMETHYLAMINO)BENZOHYDRAZIDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PG4:TETRAETHYLENE GLYCOL | |||
5hct | [A] | [A] | [A] | 1.36 | 61P:2-AMINO-N___sq___-{3-[(E)-{2-[(2S)-2-AMINO-3-(1H-INDOL-3-YL)PROPANOYL]HYDRAZINYLIDENE}METHYL]BENZYLIDENE}-3-(1H-INDOL-2-YL)PROPANEHYDRAZIDE (NON-PREFERRED NAME) ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL PG4:TETRAETHYLENE GLYCOL | |||
5hd0 | [A] | [A] | [A] | 1.65 | 60Y:3-{5-[(2E,4AR,7AR)-6-(5-FLUOROPYRIMIDIN-2-YL)-2-IMINO-3-METHYL-4-OXOOCTAHYDRO-7AH-PYRROLO[3,4-D]PYRIMIDIN-7A-YL]THIOPHEN-3-YL}BENZONITRILE TLA:L(+)-TARTARIC ACID | |||
5hdu | [A] | [A] | [A] | 1.58 | 60W:3-{5-[(2E,4AR,7AR)-6-(5-FLUORO-4-METHOXYPYRIMIDIN-2-YL)-2-IMINO-3-METHYL-4-OXOOCTAHYDRO-7AH-PYRROLO[3,4-D]PYRIMIDIN-7A-YL]THIOPHEN-3-YL}BENZONITRILE TLA:L(+)-TARTARIC ACID | |||
5hdv | [A] | [A] | [A] | 1.71 | 60V:5-[(2E,4AR,7AR)-6-(5-FLUORO-4-METHOXY-6-METHYLPYRIMIDIN-2-YL)-2-IMINO-3-METHYL-4-OXOOCTAHYDRO-7AH-PYRROLO[3,4-D]PYRIMIDIN-7A-YL]THIOPHENE-2-CARBONITRILE TLA:L(+)-TARTARIC ACID | |||
5hdx | [A] | [A] | [A] | 1.6 | 60U:5-[(2E,4AR,7AR)-6-(4-ETHOXY-5-FLUORO-6-METHYLPYRIMIDIN-2-YL)-2-IMINO-3-METHYL-4-OXOOCTAHYDRO-7AH-PYRROLO[3,4-D]PYRIMIDIN-7A-YL]THIOPHENE-2-CARBONITRILE | |||
5hdz | [A] | [A] | [A] | 1.49 | 954:5-{(2E,4AR,7AR)-6-[5-FLUORO-4-METHYL-6-(METHYLSULFANYL)PYRIMIDIN-2-YL]-2-IMINO-3-METHYL-4-OXOOCTAHYDRO-7AH-PYRROLO[3,4-D]PYRIMIDIN-7A-YL}THIOPHENE-2-CARBONITRILE | |||
5he4 | [A] | [A] | [A] | 1.53 | 60T:(2E,4AR,7AS)-7A-(2,6-DIFLUOROPHENYL)-6-(5-FLUORO-4-METHOXY-6-METHYLPYRIMIDIN-2-YL)-2-IMINO-3-METHYLOCTAHYDRO-4H-PYRROLO[3,4-D]PYRIMIDIN-4-ONE TLA:L(+)-TARTARIC ACID | |||
5he5 | [A] | [A] | [A] | 1.55 | 60S:5-{(2E,4AR,7AR)-6-[5-FLUORO-4-METHYL-6-(METHYLAMINO)PYRIMIDIN-2-YL]-2-IMINO-3-METHYL-4-OXOOCTAHYDRO-7AH-PYRROLO[3,4-D]PYRIMIDIN-7A-YL}THIOPHENE-2-CARBONITRILE TLA:L(+)-TARTARIC ACID | |||
5he7 | [A] | [A] | [A] | 1.71 | 60X:(2E,4AR,7AS)-7A-(2,4-DIFLUOROPHENYL)-6-(5-FLUORO-4-METHOXY-6-METHYLPYRIMIDIN-2-YL)-2-IMINO-3-METHYLOCTAHYDRO-4H-PYRROLO[3,4-D]PYRIMIDIN-4-ONE | |||
5htz | [A] | [A] | [A] | 1.95 | 66J:(3E,5S)-5-{3-CHLORO-5-[5-(PROP-1-YN-1-YL)PYRIDIN-3-YL]THIOPHEN-2-YL}-2,5-DIMETHYL-1,2,4-THIADIAZINAN-3-IMINE 1,1-DIOXIDE | |||
5hu0 | [A] | [A] | [A] | 1.83 | 66H:N-{3-[(2E,4R)-2-IMINO-1-METHYL-5-OXO-4-PHENYLIMIDAZOLIDIN-4-YL]PHENYL}FURAN-2-CARBOXAMIDE TLA:L(+)-TARTARIC ACID | |||
5hu1 | [A] | [A] | [A] | 1.5 | 66F:N-{3-[(5R)-3-AMINO-2,5-DIMETHYL-1,1-DIOXIDO-5,6-DIHYDRO-2H-1,2,4-THIADIAZIN-5-YL]-4-FLUOROPHENYL}-5-FLUOROPYRIDINE-2-CARBOXAMIDE | |||
5hvp | [A2][a] | [A2][a] | [A2][a] | 2 | ACE:ACETYL GROUP CL:CHLORIDE ION STA:STATINE | |||
5i3v | [A] | [A] | [A] | 1.62 | 68M:(2R)-3-[2-AMINO-6-(3-METHYLPYRIDIN-2-YL)QUINOLIN-3-YL]-N-(3,3-DIMETHYLBUTYL)-2-METHYLPROPANAMIDE GOL:GLYCEROL IOD:IODIDE ION | |||
5i3w | [A] | [A] | [A] | 2.15 | 68L:N-[(5S)-2___sq___-AMINO-3-(5,6-DIHYDRO-2H-PYRAN-3-YL)-5___sq___H-SPIRO[1-BENZOPYRANO[2,3-C]PYRIDINE-5,4___sq___-[1,3]OXAZOL]-7-YL]-5-CHLOROPYRIDINE-2-CARBOXAMIDE GOL:GLYCEROL IOD:IODIDE ION SO4:SULFATE ION | |||
5i3x | [A] | [A] | [A] | 1.85 | 68J:N-(1-{3-[2-(2-AMINO-3-{3-[(3,3-DIMETHYLBUTYL)AMINO]-3-OXOPROPYL}QUINOLIN-6-YL)PHENYL]PROP-2-YN-1-YL}CYCLOPROPYL)-4-FLUOROBENZAMIDE GOL:GLYCEROL | |||
5i3y | [A] | [A] | [A] | 2.15 | 68K:N-(6-{2-[2-(2-AMINO-3-{3-[(3,3-DIMETHYLBUTYL)AMINO]-3-OXOPROPYL}QUINOLIN-6-YL)PHENYL]ETHYL}PYRIDIN-3-YL)-4-FLUOROBENZAMIDE | |||
5i70 | [A][a] | [A][a] | [A][a] | 3 | IVA:ISOVALERIC ACID STA:STATINE | |||
5ie1 | [A] | [A] | [A] | 2.3 | 6BS:3-[2-AMINO-6-(2-METHYLPHENYL)QUINOLIN-3-YL]-N-(3,3-DIMETHYLBUTYL)PROPANAMIDE GOL:GLYCEROL IOD:IODIDE ION | |||
5is4 | [A] | [A] | [A] | 1.37 | 6LY:(1S)-2-AMINO-1-(4-BROMOPHENYL)ETHAN-1-OL ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PG4:TETRAETHYLENE GLYCOL | |||
5isj | [A] | [A] | [A] | 1.65 | 6LE:(1S)-2-AMINO-1-(4-CHLOROPHENYL)ETHAN-1-OL ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PG4:TETRAETHYLENE GLYCOL | |||
5isk | [A] | [A] | [A] | 1.14 | 6LZ:2-AMINO-1-(4-FLUOROPHENYL)ETHAN-1-ONE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PG4:TETRAETHYLENE GLYCOL PGE:TRIETHYLENE GLYCOL | |||
5ivq | [A2] | [A2] | [A2] | 1.57 | 6EH:NALPHA-(METHOXYCARBONYL)-N-{3-[(2R)-MORPHOLIN-2-YL]PROPYL}-BETA-PHENYL-L-PHENYLALANINAMIDE CL:CHLORIDE ION | |||
5ivr | [A2] | [A2] | [A2] | 1.5 | 6EG:N-{2-[(3S)-3-{[(4-AMINOPHENYL)METHYL]AMINO}-4-HYDROXYBUTYL]PHENYL}-NALPHA-(METHOXYCARBONYL)-BETA-PHENYL-L-PHENYLALANINAMIDE CL:CHLORIDE ION | |||
5ivs | [A2] | [A2] | [A2] | 1.46 | 6EF:N-(2-{2-[(2R,5S)-5-{[(BENZYLCARBAMOYL)OXY]METHYL}MORPHOLIN-2-YL]ETHYL}PHENYL)-NALPHA-(METHOXYCARBONYL)-BETA-PHENYL-L-PHENYLALANINAMIDE CL:CHLORIDE ION | |||
5ivt | [A2] | [A2] | [A2] | 1.15 | 6EE:(BETAS)-4-CHLORO-BETA-(3,5-DIFLUOROPHENYL)-N-(5-FLUORO-4-{2-[(2R,5S)-5-({[(2,2,2-TRIFLUOROETHYL)CARBAMOYL]OXY}METHYL)MORPHOLIN-2-YL]ETHYL}PYRIDIN-3-YL)-L-PHENYLALANINAMIDE ACT:ACETATE ION CL:CHLORIDE ION | |||
5j25 | [A] | [A] | [A] | 1.24 | 47K:2-(4-METHYLPIPERIDIN-1-YL)-N-[3-(PROPAN-2-YL)-1,2-OXAZOL-5-YL]ACETAMIDE ACT:ACETATE ION GOL:GLYCEROL | |||
5jfp | [A2] | [A2] | [A2] | 1.49 | 6KK:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL {(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-[(3R,5R,7R)-TRICYCLO[3.3.1.1~3,7~]DECAN-1-YL]BUTAN-2-YL}CARBAMATE CL:CHLORIDE ION NA:SODIUM ION | |||
5jfu | [A2] | [A2] | [A2] | 1.7 | 6KQ:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL {(2S,3R)-4-{BENZYL[(4-METHOXYPHENYL)SULFONYL]AMINO}-3-HYDROXY-1-[(3R,5R,7R)-TRICYCLO[3.3.1.1~3,7~]DECAN-1-YL]BUTAN-2-YL}CARBAMATE CL:CHLORIDE ION | |||
5jg1 | [A2] | [A2] | [A2] | 1.16 | 6KR:(3R,3AS,7AR)-HEXAHYDRO-4H-FURO[2,3-B]PYRAN-3-YL {(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-[(3R,5R,7R)-TRICYCLO[3.3.1.1~3,7~]DECAN-1-YL]BUTAN-2-YL}CARBAMATE CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
5jod | [A2] | [A2] | [A2] | 1.53 | GOL:GLYCEROL | |||
5kao | [A2] | [A2] | [A2] | 1.8 | G43:[(3~{A}~{S},4~{R},6~{A}~{R})-2,3,3~{A},4,5,6~{A}-HEXAHYDROFURO[2,3-B]FURAN-4-YL] ~{N}-[(2~{S},3~{R})-1-(3-CHLORANYL-4-METHOXY-PHENYL)-4-[(4-METHOXYPHENYL)SULFONYL-(2-METHYLPROPYL)AMINO]-3-OXIDANYL-BUTAN-2-YL]CARBAMATE | |||
5koq | [A] | [A] | [A] | 2.7 | 6VR:2-~{TERT}-BUTYL-4-(FURAN-2-YLMETHYLAMINO)-~{N}-(2-METHYLPROPYL)-~{N}-[(3~{S})-PIPERIDIN-3-YL]PYRIMIDINE-5-CARBOXAMIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE PEG:DI(HYDROXYETHYL)ETHER | |||
5kos | [A] | [A] | [A] | 2.41 | 6VS:2-~{TERT}-BUTYL-4-(3-METHOXYPROPYLAMINO)-~{N}-(2-METHYLPROPYL)-~{N}-[(3~{S},5~{R})-5-MORPHOLIN-4-YLCARBONYLPIPERIDIN-3-YL]PYRIMIDINE-5-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE PEG:DI(HYDROXYETHYL)ETHER | |||
5kot | [A] | [A] | [A] | 2.1 | 6VU:1-(4-METHOXYBUTYL)-~{N}-(2-METHYLPROPYL)-~{N}-[(3~{S},5~{R})-5-MORPHOLIN-4-YLCARBONYLPIPERIDIN-3-YL]BENZIMIDAZOLE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE PEG:DI(HYDROXYETHYL)ETHER PGE:TRIETHYLENE GLYCOL | |||
5kqf | [A] | [A] | [A] | 1.98 | 6WD:(4~{S},6~{S})-4-[2,4-BIS(FLUORANYL)PHENYL]-4-METHYL-6-PYRIMIDIN-5-YL-5,6-DIHYDRO-1,3-THIAZIN-2-AMINE | |||
5kqx | [A2] | [A2] | [A2] | 2.4 | ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
5kqy | [A2] | [A2] | [A2] | 1.65 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
5kqz | [A2] | [A2] | [A2] | 1.7 | 0Q4:N-[(2R)-2-({N~5~-[AMINO(IMINIO)METHYL]-L-ORNITHYL-L-VALYL}AMINO)-4-METHYLPENTYL]-L-PHENYLALANYL-L-ALPHA-GLUTAMYL-L-ALANYL-L-NORLEUCINAMIDE | |||
5kr0 | [A2] | [A2] | [A2] | 1.8 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER GOL:GLYCEROL | |||
5kr1 | [A2] | [A2] | [A2] | 1.6 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
5kr2 | [A4] | [A4] | [A4] | 1.78 | ROC:(2S)-N-[(2S,3R)-4-[(2S,3S,4AS,8AS)-3-(TERT-BUTYLCARBAMOYL)-3,4,4A,5,6,7,8,8A-OCTAHYDRO-1H-ISOQUINOLIN-2-YL]-3-HYDROXY-1-PHENYL-BUTAN-2-YL]-2-(QUINOLIN-2-YLCARBONYLAMINO)BUTANEDIAMIDE | |||
5kr8 | [A] | [A] | [A] | 2.12 | 6WE:(4~{S},6~{S})-4-[2,4-BIS(FLUORANYL)PHENYL]-6-(3,5-DIMETHYL-1,2-OXAZOL-4-YL)-4-METHYL-5,6-DIHYDRO-1,3-THIAZIN-2-AMINE IOD:IODIDE ION | |||
5lwr | [A] | [A] | [A] | 1.25 | 7B2:4-[12-[(1-CHLORANYL-5,6,7-TRIMETHYL-PYRROLO[3,4-D]PYRIDAZIN-3-IUM-3-YL)METHYL]-10,11-DIMETHYL-3,4,6,7,11-PENTAZATRICYCLO[7.3.0.0^{2,6}]DODECA-1(12),2,4,7,9-PENTAEN-5-YL]-1,2,5-TRIMETHYL-PYRROLE-3-CARBALDEHYDE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
5lws | [A] | [A] | [A] | 1.03 | 7B2:4-[12-[(1-CHLORANYL-5,6,7-TRIMETHYL-PYRROLO[3,4-D]PYRIDAZIN-3-IUM-3-YL)METHYL]-10,11-DIMETHYL-3,4,6,7,11-PENTAZATRICYCLO[7.3.0.0^{2,6}]DODECA-1(12),2,4,7,9-PENTAEN-5-YL]-1,2,5-TRIMETHYL-PYRROLE-3-CARBALDEHYDE 7B4:4-CHLORANYL-5,6,7-TRIMETHYL-PYRROLO[3,4-D]PYRIDAZINE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL TFA:TRIFLUOROACETIC ACID | |||
5lwt | [A] | [A] | [A] | 1.07 | 7B3:4-METHOXY-5,6,7-TRIMETHYL-PYRROLO[3,4-D]PYRIDAZINE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL TFA:TRIFLUOROACETIC ACID | |||
5lwu | [A] | [A] | [A] | 1.11 | ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL TFA:TRIFLUOROACETIC ACID | |||
5mb0 | [A] | [A] | [A] | 1.15 | 47V:2,5-DIMETHYL-N-(PYRIDIN-4-YL)FURAN-3-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE F63:N-METHYL-1-[5-(PYRIDIN-3-YLOXY)FURAN-2-YL]METHANAMINE F91:N-(PYRIDIN-4-YLMETHYL)-2,3-DIHYDRO-1,4-BENZODIOXIN-6-AMINE GOL:GLYCEROL | |||
5mb3 | [A] | [A] | [A] | 1.05 | 5GL:4-PROPAN-2-YLSULFANYL-1-PROPYL-6,7-DIHYDRO-5~{H}-CYCLOPENTA[D]PYRIMIDIN-2-ONE ACT:ACETATE ION GOL:GLYCEROL | |||
5mb5 | [A] | [A] | [A] | 0.98 | 46P:4-METHYL-5-(1-METHYL-1H-IMIDAZOL-2-YL)-1,3-THIAZOL-2-AMINE ACT:ACETATE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL | |||
5mb6 | [A] | [A] | [A] | 1.2 | GOL:GLYCEROL SO4:SULFATE ION | |||
5mb7 | [A] | [A] | [A] | 1.3 | 4AV:1-(2-CHLORO-5-NITROPHENYL)-N-METHYLMETHANAMINE GOL:GLYCEROL | |||
5mbw | [A][a] | [A][a] | [A][a] | 2.95 | CL:CHLORIDE ION DPR:D-PROLINE STA:STATINE | |||
5mco | [A][a] | [A][a] | [A][a] | 2.49 | ACE:ACETYL GROUP BSD:N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-5-[METHYL(METHYLSULFONYL)AMINO]-N___sq___-[(1R)-1-PHENYLETHYL]BENZENE-1,3-DICARBOXAMIDE | |||
5mcq | [A][a] | [A][a] | [A][a] | 1.82 | DLY:D-LYSINE DPR:D-PROLINE EDO:1,2-ETHANEDIOL NH2:AMINO GROUP STA:STATINE | |||
5mkt | [A] | [A] | [A] | 3.2 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
5mlg | [A] | [A] | [A] | 2.6 | NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
5mxd | [A] | [A] | [A] | 2.52 | CL:CHLORIDE ION III:~{N},~{N}-DIMETHYL-2-PYRROLIDIN-1-YL-QUINAZOLIN-4-AMINE | |||
5n70 | [A] | [A] | [A] | 1.81 | ||||
5n71 | [A] | [A] | [A] | 1.88 | PEG:DI(HYDROXYETHYL)ETHER SO4:SULFATE ION | |||
5n7n | [A] | [A] | [A] | 2.3 | NH4:AMMONIUM ION SO4:SULFATE ION | |||
5n7q | [A][a] | [A][a] | [A][a] | 1.45 | GOL:GLYCEROL IVA:ISOVALERIC ACID PEG:DI(HYDROXYETHYL)ETHER STA:STATINE | |||
5nfg | [A] | [A] | [A] | 2.38 | BMA:BETA-D-MANNOPYRANOSE MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
5og7 | [A] | [A] | [A] | 1.82 | DMS:DIMETHYL SULFOXIDE FLK:3-CHLORANYL-~{N}___sq___-(4,5-DIHYDRO-1~{H}-IMIDAZOL-3-IUM-2-YL)PROPANEHYDRAZIDE | |||
5oje | [A] | [A] | [A] | 1.58 | DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL PGE:TRIETHYLENE GLYCOL SO4:SULFATE ION VSK:(2~{S})-2-AZANYL-3-(1~{H}-INDOL-3-YL)-~{N}-[2-(2,4,6-TRIMETHYLPHENYL)ETHYL]PROPANAMIDE | |||
5oyq | [A] | [A] | [A] | 1.49 | ||||
5oyr | [A] | [A] | [A] | 1.49 | ||||
5oys | [A] | [A] | [A] | 1.65 | ||||
5oyt | [A] | [A] | [A] | 1.59 | ||||
5oyu | [A] | [A] | [A] | 1.25 | ||||
5oyv | [A] | [A] | [A] | 1.44 | ||||
5oyw | [A] | [A] | [A] | 1.48 | ||||
5oyx | [A] | [A] | [A] | 1.65 | ||||
5oyy | [A] | [A] | [A] | 1.45 | ||||
5oyz | [A] | [A] | [A] | 1.49 | ||||
5oz0 | [A] | [A] | [A] | 1.45 | ||||
5oz1 | [A] | [A] | [A] | 1.48 | ||||
5oz2 | [A] | [A] | [A] | 1.61 | ||||
5oz3 | [A] | [A] | [A] | 1.75 | ||||
5oz4 | [A] | [A] | [A] | 1.48 | ||||
5oz5 | [A] | [A] | [A] | 1.49 | ||||
5oz6 | [A] | [A] | [A] | 1.55 | ||||
5oz7 | [A] | [A] | [A] | 1.61 | ||||
5oz8 | [A] | [A] | [A] | 1.56 | ||||
5oz9 | [A] | [A] | [A] | 1.61 | ||||
5oza | [A] | [A] | [A] | 1.49 | ||||
5ozb | [A] | [A] | [A] | 1.49 | ||||
5ozc | [A] | [A] | [A] | 1.71 | ||||
5ozd | [A] | [A] | [A] | 1.37 | ||||
5oze | [A] | [A] | [A] | 1.24 | ||||
5ozf | [A] | [A] | [A] | 1.53 | ||||
5ozg | [A] | [A] | [A] | 1.49 | ||||
5ozh | [A] | [A] | [A] | 1.49 | ||||
5ozi | [A] | [A] | [A] | 1.5 | ||||
5ozj | [A] | [A] | [A] | 1.49 | ||||
5ozk | [A] | [A] | [A] | 1.33 | ||||
5ozl | [A] | [A] | [A] | 1.74 | ||||
5ozm | [A] | [A] | [A] | 1.49 | ||||
5ozn | [A] | [A] | [A] | 1.49 | ||||
5ozo | [A] | [A] | [A] | 1.58 | ||||
5ozp | [A] | [A] | [A] | 1.49 | ||||
5ozq | [A] | [A] | [A] | 1.5 | ||||
5ozr | [A] | [A] | [A] | 1.77 | ||||
5ozs | [A] | [A] | [A] | 1.72 | ||||
5ozt | [A] | [A] | [A] | 1.8 | ||||
5ozu | [A] | [A] | [A] | 1.12 | ||||
5ozv | [A] | [A] | [A] | 1.48 | ||||
5ozw | [A] | [A] | [A] | 1.54 | ||||
5ozx | [A] | [A] | [A] | 1.48 | ||||
5ozy | [A] | [A] | [A] | 1.49 | ||||
5ozz | [A] | [A] | [A] | 1.53 | ||||
5p00 | [A] | [A] | [A] | 1.51 | ||||
5p01 | [A] | [A] | [A] | 1.51 | ||||
5p02 | [A] | [A] | [A] | 1.49 | ||||
5p03 | [A] | [A] | [A] | 1.49 | ||||
5p04 | [A] | [A] | [A] | 1.67 | ||||
5p05 | [A] | [A] | [A] | 1.6 | ||||
5p06 | [A] | [A] | [A] | 1.32 | ||||
5p07 | [A] | [A] | [A] | 1.62 | ||||
5p08 | [A] | [A] | [A] | 1.61 | ||||
5p09 | [A] | [A] | [A] | 1.61 | ||||
5p0a | [A] | [A] | [A] | 1.82 | ||||
5p0b | [A] | [A] | [A] | 1.63 | ||||
5p0c | [A] | [A] | [A] | 1.82 | ||||
5p0d | [A] | [A] | [A] | 1.85 | ||||
5p0e | [A] | [A] | [A] | 1.8 | ||||
5p0f | [A] | [A] | [A] | 1.25 | ||||
5p0g | [A] | [A] | [A] | 1.49 | ||||
5p0h | [A] | [A] | [A] | 1.8 | ||||
5p0i | [A] | [A] | [A] | 1.15 | ||||
5p0j | [A] | [A] | [A] | 1.15 | ||||
5p0k | [A] | [A] | [A] | 1.6 | ||||
5p0l | [A] | [A] | [A] | 1.51 | ||||
5p0m | [A] | [A] | [A] | 1.12 | ||||
5p0n | [A] | [A] | [A] | 1.14 | ||||
5p0o | [A] | [A] | [A] | 1.33 | ||||
5p0p | [A] | [A] | [A] | 1.3 | ||||
5p0q | [A] | [A] | [A] | 1.48 | ||||
5p0r | [A] | [A] | [A] | 1.25 | ||||
5p0s | [A] | [A] | [A] | 1.2 | ||||
5p0t | [A] | [A] | [A] | 1.13 | ||||
5p0u | [A] | [A] | [A] | 1.46 | ||||
5p0v | [A] | [A] | [A] | 1.4 | ||||
5p0w | [A] | [A] | [A] | 1.27 | ||||
5p0x | [A] | [A] | [A] | 1.27 | ||||
5p0y | [A] | [A] | [A] | 1.32 | ||||
5p0z | [A] | [A] | [A] | 1.26 | ||||
5p10 | [A] | [A] | [A] | 1.49 | ||||
5p11 | [A] | [A] | [A] | 1.38 | ||||
5p12 | [A] | [A] | [A] | 1.55 | ||||
5p13 | [A] | [A] | [A] | 1.4 | ||||
5p14 | [A] | [A] | [A] | 1.24 | ||||
5p15 | [A] | [A] | [A] | 1.41 | ||||
5p16 | [A] | [A] | [A] | 1.64 | ||||
5p17 | [A] | [A] | [A] | 1.4 | ||||
5p18 | [A] | [A] | [A] | 1.35 | ||||
5p19 | [A] | [A] | [A] | 1.13 | ||||
5p1a | [A] | [A] | [A] | 1.4 | ||||
5p1b | [A] | [A] | [A] | 1.38 | ||||
5p1c | [A] | [A] | [A] | 1.35 | ||||
5p1d | [A] | [A] | [A] | 1.28 | ||||
5p1e | [A] | [A] | [A] | 1.59 | ||||
5p1f | [A] | [A] | [A] | 1.26 | ||||
5p1g | [A] | [A] | [A] | 1.48 | ||||
5p1h | [A] | [A] | [A] | 1.53 | ||||
5p1i | [A] | [A] | [A] | 1.34 | ||||
5p1j | [A] | [A] | [A] | 1.37 | ||||
5p1k | [A] | [A] | [A] | 1.55 | ||||
5p1l | [A] | [A] | [A] | 1.25 | ||||
5p1m | [A] | [A] | [A] | 1.6 | ||||
5p1n | [A] | [A] | [A] | 1.52 | ||||
5p1o | [A] | [A] | [A] | 1.52 | ||||
5p1p | [A] | [A] | [A] | 1.32 | ||||
5p1q | [A] | [A] | [A] | 1.17 | ||||
5p1r | [A] | [A] | [A] | 1.33 | ||||
5p1s | [A] | [A] | [A] | 1.32 | ||||
5p1t | [A] | [A] | [A] | 1.4 | ||||
5p1u | [A] | [A] | [A] | 1.5 | ||||
5p1v | [A] | [A] | [A] | 1.3 | ||||
5p1w | [A] | [A] | [A] | 1.23 | ||||
5p1x | [A] | [A] | [A] | 1.2 | ||||
5p1y | [A] | [A] | [A] | 1.52 | ||||
5p1z | [A] | [A] | [A] | 1.46 | ||||
5p20 | [A] | [A] | [A] | 1.44 | ||||
5p22 | [A] | [A] | [A] | 1.31 | ||||
5p23 | [A] | [A] | [A] | 1.71 | ||||
5p24 | [A] | [A] | [A] | 1.71 | ||||
5p25 | [A] | [A] | [A] | 1.26 | ||||
5p26 | [A] | [A] | [A] | 1.41 | ||||
5p27 | [A] | [A] | [A] | 1.45 | ||||
5p28 | [A] | [A] | [A] | 1.35 | ||||
5p29 | [A] | [A] | [A] | 1.48 | ||||
5p2a | [A] | [A] | [A] | 1.37 | ||||
5p2b | [A] | [A] | [A] | 1.7 | ||||
5p2c | [A] | [A] | [A] | 1.75 | ||||
5p2d | [A] | [A] | [A] | 1.3 | ||||
5p2e | [A] | [A] | [A] | 1.53 | ||||
5p2f | [A] | [A] | [A] | 1.8 | ||||
5p2g | [A] | [A] | [A] | 1.49 | ||||
5p2h | [A] | [A] | [A] | 1.62 | ||||
5p2i | [A] | [A] | [A] | 1.43 | ||||
5p2j | [A] | [A] | [A] | 1.56 | ||||
5p2k | [A] | [A] | [A] | 1.82 | ||||
5p2l | [A] | [A] | [A] | 1.12 | ||||
5p2m | [A] | [A] | [A] | 1.09 | ||||
5p2n | [A] | [A] | [A] | 1.55 | ||||
5p2o | [A] | [A] | [A] | 1.12 | ||||
5p2q | [A] | [A] | [A] | 1.35 | ||||
5p2r | [A] | [A] | [A] | 1.17 | ||||
5p2s | [A] | [A] | [A] | 1.08 | ||||
5p2t | [A] | [A] | [A] | 1.1 | ||||
5p2u | [A] | [A] | [A] | 1.38 | ||||
5p2v | [A] | [A] | [A] | 1.32 | ||||
5p2w | [A] | [A] | [A] | 1.52 | ||||
5p2x | [A] | [A] | [A] | 1.4 | ||||
5p2y | [A] | [A] | [A] | 1.64 | ||||
5p2z | [A] | [A] | [A] | 1.52 | ||||
5p30 | [A] | [A] | [A] | 1.85 | ||||
5p31 | [A] | [A] | [A] | 1.25 | ||||
5p32 | [A] | [A] | [A] | 1.12 | ||||
5p33 | [A] | [A] | [A] | 1.26 | ||||
5p34 | [A] | [A] | [A] | 1.21 | ||||
5p35 | [A] | [A] | [A] | 1.24 | ||||
5p36 | [A] | [A] | [A] | 1.37 | ||||
5p37 | [A] | [A] | [A] | 1.42 | ||||
5p38 | [A] | [A] | [A] | 1.29 | ||||
5p39 | [A] | [A] | [A] | 1.19 | ||||
5p3a | [A] | [A] | [A] | 1.18 | ||||
5p3b | [A] | [A] | [A] | 1.24 | ||||
5p3c | [A] | [A] | [A] | 1.27 | ||||
5p3d | [A] | [A] | [A] | 1.18 | ||||
5p3e | [A] | [A] | [A] | 1.17 | ||||
5p3f | [A] | [A] | [A] | 1.26 | ||||
5p3g | [A] | [A] | [A] | 1.39 | ||||
5p3h | [A] | [A] | [A] | 1.39 | ||||
5p3i | [A] | [A] | [A] | 1.25 | ||||
5p3j | [A] | [A] | [A] | 1.34 | ||||
5p3k | [A] | [A] | [A] | 1.75 | ||||
5p3l | [A] | [A] | [A] | 1.25 | ||||
5p3m | [A] | [A] | [A] | 1.19 | ||||
5p3n | [A] | [A] | [A] | 1.44 | ||||
5p3o | [A] | [A] | [A] | 1.25 | ||||
5p3p | [A] | [A] | [A] | 1.46 | ||||
5p3q | [A] | [A] | [A] | 1.09 | ||||
5p3r | [A] | [A] | [A] | 1.37 | ||||
5p3s | [A] | [A] | [A] | 1.17 | ||||
5p3t | [A] | [A] | [A] | 1.19 | ||||
5p3u | [A] | [A] | [A] | 1.2 | ||||
5p3v | [A] | [A] | [A] | 1.47 | ||||
5p3w | [A] | [A] | [A] | 1.24 | ||||
5p3x | [A] | [A] | [A] | 1.42 | ||||
5p3y | [A] | [A] | [A] | 1.22 | ||||
5p3z | [A] | [A] | [A] | 1.2 | ||||
5p40 | [A] | [A] | [A] | 1.23 | ||||
5p41 | [A] | [A] | [A] | 1.28 | ||||
5p42 | [A] | [A] | [A] | 1.18 | ||||
5p43 | [A] | [A] | [A] | 1.19 | ||||
5p44 | [A] | [A] | [A] | 1.18 | ||||
5p45 | [A] | [A] | [A] | 1.19 | ||||
5p46 | [A] | [A] | [A] | 1.18 | ||||
5p47 | [A] | [A] | [A] | 1.18 | ||||
5p48 | [A] | [A] | [A] | 1.17 | ||||
5p49 | [A] | [A] | [A] | 1.26 | ||||
5p4a | [A] | [A] | [A] | 1.35 | ||||
5p4b | [A] | [A] | [A] | 1.2 | ||||
5p4c | [A] | [A] | [A] | 1.26 | ||||
5p4d | [A] | [A] | [A] | 1.25 | ||||
5p4e | [A] | [A] | [A] | 1.4 | ||||
5p4f | [A] | [A] | [A] | 1.41 | ||||
5p4g | [A] | [A] | [A] | 1.16 | ||||
5p4h | [A] | [A] | [A] | 1.45 | ||||
5p4i | [A] | [A] | [A] | 1.42 | ||||
5p4j | [A] | [A] | [A] | 1.52 | ||||
5p4k | [A] | [A] | [A] | 1.47 | ||||
5p4l | [A] | [A] | [A] | 1.08 | ||||
5p4m | [A] | [A] | [A] | 1.07 | ||||
5p4n | [A] | [A] | [A] | 1.25 | ||||
5p4o | [A] | [A] | [A] | 1.06 | ||||
5p4p | [A] | [A] | [A] | 1.57 | ||||
5p4q | [A] | [A] | [A] | 1.59 | ||||
5p4r | [A] | [A] | [A] | 1.13 | ||||
5p4s | [A] | [A] | [A] | 1.31 | ||||
5p4t | [A] | [A] | [A] | 1.7 | ||||
5p4u | [A] | [A] | [A] | 1.32 | ||||
5p4v | [A] | [A] | [A] | 1.33 | ||||
5p4w | [A] | [A] | [A] | 1.15 | ||||
5p4x | [A] | [A] | [A] | 1.58 | ||||
5p4y | [A] | [A] | [A] | 1.41 | ||||
5p4z | [A] | [A] | [A] | 1.25 | ||||
5p50 | [A] | [A] | [A] | 1.12 | ||||
5p51 | [A] | [A] | [A] | 1.12 | ||||
5p52 | [A] | [A] | [A] | 1.27 | ||||
5p53 | [A] | [A] | [A] | 1.12 | ||||
5p54 | [A] | [A] | [A] | 1.09 | ||||
5p55 | [A] | [A] | [A] | 1.3 | ||||
5p56 | [A] | [A] | [A] | 1.5 | ||||
5p57 | [A] | [A] | [A] | 1.42 | ||||
5p58 | [A] | [A] | [A] | 1.12 | ||||
5p59 | [A] | [A] | [A] | 1.18 | ||||
5p5a | [A] | [A] | [A] | 1.27 | ||||
5p5b | [A] | [A] | [A] | 1.21 | ||||
5p5c | [A] | [A] | [A] | 1.34 | ||||
5p5d | [A] | [A] | [A] | 1.58 | ||||
5p5e | [A] | [A] | [A] | 1.27 | ||||
5p5f | [A] | [A] | [A] | 1.3 | ||||
5p5g | [A] | [A] | [A] | 1.66 | ||||
5p5h | [A] | [A] | [A] | 1.09 | ||||
5p5i | [A] | [A] | [A] | 1.18 | ||||
5p5j | [A] | [A] | [A] | 1.17 | ||||
5p5k | [A] | [A] | [A] | 1.26 | ||||
5p5l | [A] | [A] | [A] | 1.73 | ||||
5p5m | [A] | [A] | [A] | 1.18 | ||||
5p5n | [A] | [A] | [A] | 1.69 | ||||
5p5o | [A] | [A] | [A] | 1.2 | ||||
5p5p | [A] | [A] | [A] | 1.09 | ||||
5p5q | [A] | [A] | [A] | 1.28 | ||||
5p5r | [A] | [A] | [A] | 1.31 | ||||
5p5s | [A] | [A] | [A] | 1.14 | ||||
5p5t | [A] | [A] | [A] | 1.18 | ||||
5p5u | [A] | [A] | [A] | 1.42 | ||||
5p5v | [A] | [A] | [A] | 1.06 | ||||
5p5w | [A] | [A] | [A] | 1.3 | ||||
5p5x | [A] | [A] | [A] | 1.07 | ||||
5p5y | [A] | [A] | [A] | 1.14 | ||||
5p5z | [A] | [A] | [A] | 1.17 | ||||
5p60 | [A] | [A] | [A] | 1.24 | ||||
5p61 | [A] | [A] | [A] | 1.09 | ||||
5p62 | [A] | [A] | [A] | 1.28 | ||||
5p63 | [A] | [A] | [A] | 1.2 | ||||
5p64 | [A] | [A] | [A] | 1.07 | ||||
5p65 | [A] | [A] | [A] | 1.1 | ||||
5p66 | [A] | [A] | [A] | 1.19 | ||||
5p67 | [A] | [A] | [A] | 1.12 | ||||
5p68 | [A] | [A] | [A] | 1.25 | ||||
5p69 | [A] | [A] | [A] | 1.44 | ||||
5p6a | [A] | [A] | [A] | 1.16 | ||||
5p6b | [A] | [A] | [A] | 1.47 | ||||
5p6c | [A] | [A] | [A] | 1.34 | ||||
5p6d | [A] | [A] | [A] | 1.44 | ||||
5p6e | [A] | [A] | [A] | 1.21 | ||||
5p6f | [A] | [A] | [A] | 1.13 | ||||
5p6g | [A] | [A] | [A] | 1.09 | ||||
5p6h | [A] | [A] | [A] | 1.45 | ||||
5p6i | [A] | [A] | [A] | 1.2 | ||||
5p6j | [A] | [A] | [A] | 1.26 | ||||
5p6k | [A] | [A] | [A] | 1.61 | ||||
5p6l | [A] | [A] | [A] | 1.05 | ||||
5p6m | [A] | [A] | [A] | 1.35 | ||||
5p6n | [A] | [A] | [A] | 1.11 | ||||
5p6o | [A] | [A] | [A] | 1.13 | ||||
5p6p | [A] | [A] | [A] | 1.28 | ||||
5p6q | [A] | [A] | [A] | 1.24 | ||||
5p6r | [A] | [A] | [A] | 1.27 | ||||
5p6s | [A] | [A] | [A] | 1.34 | ||||
5p6t | [A] | [A] | [A] | 1.46 | ||||
5p6u | [A] | [A] | [A] | 1.06 | ||||
5p6v | [A] | [A] | [A] | 1.28 | ||||
5p6w | [A] | [A] | [A] | 1.61 | ||||
5p6x | [A] | [A] | [A] | 1.4 | ||||
5p6y | [A] | [A] | [A] | 1.18 | ||||
5p6z | [A] | [A] | [A] | 1.28 | ||||
5p70 | [A] | [A] | [A] | 1.02 | ||||
5p71 | [A] | [A] | [A] | 1.03 | ||||
5p72 | [A] | [A] | [A] | 1.05 | ||||
5p73 | [A] | [A] | [A] | 1.02 | ||||
5p74 | [A] | [A] | [A] | 1.04 | ||||
5p75 | [A] | [A] | [A] | 1.43 | ||||
5p76 | [A] | [A] | [A] | 1.04 | ||||
5p77 | [A] | [A] | [A] | 1.03 | ||||
5p78 | [A] | [A] | [A] | 1.69 | ||||
5p79 | [A] | [A] | [A] | 1.13 | ||||
5p7a | [A] | [A] | [A] | 1.25 | ||||
5p7b | [A] | [A] | [A] | 1.41 | ||||
5p7c | [A] | [A] | [A] | 1.27 | ||||
5p7d | [A] | [A] | [A] | 1.17 | ||||
5p7e | [A] | [A] | [A] | 1.23 | ||||
5p7f | [A] | [A] | [A] | 1.08 | ||||
5p7g | [A] | [A] | [A] | 1.1 | ||||
5p7h | [A] | [A] | [A] | 1.19 | ||||
5p7i | [A] | [A] | [A] | 1.19 | ||||
5p7j | [A] | [A] | [A] | 1.31 | ||||
5p7k | [A] | [A] | [A] | 1.1 | ||||
5p7l | [A] | [A] | [A] | 1.17 | ||||
5p7m | [A] | [A] | [A] | 1.33 | ||||
5p7n | [A] | [A] | [A] | 1.65 | ||||
5p7o | [A] | [A] | [A] | 1.48 | ||||
5p7p | [A] | [A] | [A] | 1.44 | ||||
5p7q | [A] | [A] | [A] | 1.11 | ||||
5p7r | [A] | [A] | [A] | 1.48 | ||||
5p7s | [A] | [A] | [A] | 1.19 | ||||
5p7t | [A] | [A] | [A] | 1.46 | ||||
5p7u | [A] | [A] | [A] | 1.1 | ||||
5p7v | [A] | [A] | [A] | 1.28 | ||||
5p7w | [A] | [A] | [A] | 1.36 | ||||
5p7x | [A] | [A] | [A] | 1.47 | ||||
5p7y | [A] | [A] | [A] | 1.65 | ||||
5p7z | [A] | [A] | [A] | 1.26 | ||||
5p80 | [A] | [A] | [A] | 1.24 | ||||
5p81 | [A] | [A] | [A] | 1.6 | ||||
5p82 | [A] | [A] | [A] | 1.22 | ||||
5p83 | [A] | [A] | [A] | 1.52 | ||||
5p84 | [A] | [A] | [A] | 1.29 | ||||
5p85 | [A] | [A] | [A] | 1.23 | ||||
5p86 | [A] | [A] | [A] | 1.33 | ||||
5p87 | [A] | [A] | [A] | 1.35 | ||||
5p88 | [A] | [A] | [A] | 1.22 | ||||
5p89 | [A] | [A] | [A] | 1.27 | ||||
5p8a | [A] | [A] | [A] | 1.27 | ||||
5p8b | [A] | [A] | [A] | 1.55 | ||||
5p8c | [A] | [A] | [A] | 1.3 | ||||
5p8d | [A] | [A] | [A] | 1.18 | ||||
5p8e | [A] | [A] | [A] | 1.22 | ||||
5p8f | [A] | [A] | [A] | 1.27 | ||||
5p8g | [A] | [A] | [A] | 1.28 | ||||
5p8h | [A] | [A] | [A] | 1.24 | ||||
5p8i | [A] | [A] | [A] | 1.22 | ||||
5p8j | [A] | [A] | [A] | 1.33 | ||||
5p8k | [A] | [A] | [A] | 1.26 | ||||
5p8l | [A] | [A] | [A] | 1.24 | ||||
5p8m | [A] | [A] | [A] | 1.2 | ||||
5p8n | [A] | [A] | [A] | 1.49 | ||||
5p8o | [A] | [A] | [A] | 1.48 | ||||
5p8p | [A] | [A] | [A] | 1.22 | ||||
5p8q | [A] | [A] | [A] | 1.14 | ||||
5p8r | [A] | [A] | [A] | 1.07 | ||||
5p8s | [A] | [A] | [A] | 1.11 | ||||
5p8t | [A] | [A] | [A] | 1.03 | ||||
5p8u | [A] | [A] | [A] | 1.44 | ||||
5p8v | [A] | [A] | [A] | 1.58 | ||||
5pep | [A] | [A] | [A] | 2.34 | ||||
5sxn | [A] | [A] | [A] | 2.1 | 74U:N-[(FURAN-2-YL)METHYL]-2-PHENYLQUINAZOLIN-4-AMINE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE PEG:DI(HYDROXYETHYL)ETHER PGE:TRIETHYLENE GLYCOL | |||
5sy2 | [A] | [A] | [A] | 2.25 | 1PE:PENTAETHYLENE GLYCOL 74V:N-ETHYL-4-{[(FURAN-2-YL)METHYL]AMINO}-2-METHYL-N-[(3S)-PIPERIDIN-3-YL]PYRIMIDINE-5-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE PGE:TRIETHYLENE GLYCOL | |||
5sy3 | [A] | [A] | [A] | 2.3 | 1PE:PENTAETHYLENE GLYCOL 74Z:N-[(FURAN-2-YL)METHYL]-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4-AMINE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE PEG:DI(HYDROXYETHYL)ETHER | |||
5sz9 | [A] | [A] | [A] | 2.85 | 74Y:(AZEPAN-1-YL)(2-{[(FURAN-2-YL)METHYL]AMINO}-6-METHYLPYRIDIN-3-YL)METHANONE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE PEG:DI(HYDROXYETHYL)ETHER PGE:TRIETHYLENE GLYCOL | |||
5t1u | [A] | [A] | [A] | 1.78 | EDO:1,2-ETHANEDIOL IOD:IODIDE ION P6U:(4S)-4-[2,4-DIFLUORO-5-({[1-(TRIFLUOROMETHYL)CYCLOPROPYL]AMINO}METHYL)PHENYL]-4-METHYL-5,6-DIHYDRO-4H-1,3-THIAZIN-2-AMINE | |||
5t1w | [A] | [A] | [A] | 2.96 | 74B:(4AR,6R,8AS)-8A-(2,4-DIFLUORO-5-{[(2,2,2-TRIFLUOROETHYL)AMINO]METHYL}PHENYL)-6-(FLUOROMETHYL)-4,4A,5,6,8,8A-HEXAHYDROPYRANO[3,4-D][1,3]THIAZIN-2-AMINE CL:CHLORIDE ION DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL IOD:IODIDE ION NA:SODIUM ION | |||
5t2e | [A2] | [A2] | [A2] | 1.5 | CL:CHLORIDE ION | |||
5t2z | [A2] | [A2] | [A2] | 1.5 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
5t4s | [A] | [A] | [A] | 2.64 | 77O:6-CHLORO-N-[(FURAN-2-YL)METHYL]PYRAZIN-2-AMINE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE PG6:1-(2-METHOXY-ETHOXY)-2-{2-[2-(2-METHOXY-ETHOXY]-ETHOXY}-ETHANE PGE:TRIETHYLENE GLYCOL | |||
5t84 | [A2] | [A2] | [A2] | 1.65 | ||||
5t8h | [A2] | [A2] | [A2] | 1.85 | 478:{3-[(4-AMINO-BENZENESULFONYL)-ISOBUTYL-AMINO]-1-BENZYL-2-HYDROXY-PROPYL}-CARBAMIC ACID TETRAHYDRO-FURAN-3-YLESTER | |||
5tmg | [A] | [A] | [A] | 2.2 | 7EK:5-(4-METHOXYBUTYL)-N-(2-METHYLPROPYL)-N-[(3S,5R)-5-(MORPHOLINE-4-CARBONYL)PIPERIDIN-3-YL]-1-PHENYL-1H-1,2,3-TRIAZOLE-4-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE PEG:DI(HYDROXYETHYL)ETHER PGE:TRIETHYLENE GLYCOL | |||
5tmk | [A] | [A] | [A] | 2.65 | 7EJ:1-(4-METHOXYBUTYL)-N-(2-METHYLPROPYL)-N-[(3S,5R)-5-(MORPHOLINE-4-CARBONYL)PIPERIDIN-3-YL]-5-PHENYL-1H-PYRROLE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE PEG:DI(HYDROXYETHYL)ETHER | |||
5tol | [A] | [A] | [A] | 2.51 | 7H3:N-{3-[(4AR,7AR)-2-AMINO-4,4A,5,6-TETRAHYDRO-7AH-FURO[2,3-D][1,3]THIAZIN-7A-YL]-4-FLUOROPHENYL}-5-BROMOPYRIDINE-2-CARBOXAMIDE | |||
5tyr | [A2] | [A2] | [A2] | 1.8 | 7O7:(3S,3AR,5R,7AS,8S)-HEXAHYDRO-4H-3,5-METHANOFURO[2,3-B]PYRAN-8-YL {(2S,3R)-4-[{[2-(CYCLOPROPYLAMINO)-1,3-BENZOTHIAZOL-6-YL]SULFONYL}(2-METHYLPROPYL)AMINO]-3-HYDROXY-1-PHENYLBUTAN-2-YL}CARBAMATE | |||
5tys | [A2] | [A2] | [A2] | 2.01 | 7OA:(3S,3AR,5R,7AS,8S)-HEXAHYDRO-4H-3,5-METHANOFURO[2,3-B]PYRAN-8-YL [(2S,3R)-4-[{[2-(CYCLOPROPYLAMINO)-1,3-BENZOTHIAZOL-6-YL]SULFONYL}(2-METHYLPROPYL)AMINO]-1-(3,5-DIFLUOROPHENYL)-3-HYDROXYBUTAN-2-YL]CARBAMATE | |||
5ufz | [A2] | [A2] | [A2] | 1.65 | 8BG:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2S)-1-(1-{[(4-AMINOPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}CYCLOPROPYL)-1-HYDROXY-3-PHENYLPROPAN-2-YL]CARBAMATE | |||
5ult | [A2] | [A2] | [A2] | 1.53 | 8FM:(3S,3AR,5R,7AS,8S)-HEXAHYDRO-4H-3,5-METHANOFURO[2,3-B]PYRAN-8-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE CL:CHLORIDE ION NA:SODIUM ION | |||
5uov | [A2] | [A2] | [A2] | 1.33 | 8FP:N-[(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]-3-[(2R)-2-(4-METHYL-1,3-THIAZOL-2-YL)PYRROLIDINE-1-CARBONYL]BENZAMIDE ACT:ACETATE ION CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
5upj | [A2] | [A2] | [A2] | 2.3 | UIN:5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY-3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN-2-ONE | |||
5upz | [A2] | [A2] | [A2] | 1.27 | 8HD:N~3~-{(2S,3R)-3-HYDROXY-4-[{[4-(HYDROXYMETHYL)PHENYL]SULFONYL}(2-METHYLPROPYL)AMINO]-1-PHENYLBUTAN-2-YL}-N~1~-METHYL-N~1~-[(4-METHYL-1,3-OXAZOL-2-YL)METHYL]BENZENE-1,3-DICARBOXAMIDE CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION | |||
5ux4 | [A] | [A] | [A] | 2.81 | 3UT:(5S)-3-(5,6-DIHYDRO-2H-PYRAN-3-YL)-1-FLUORO-7-(2-FLUOROPYRIDIN-3-YL)SPIRO[CHROMENO[2,3-C]PYRIDINE-5,4___sq___-[1,3]OXAZOL]-2___sq___-AMINE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
5uyu | [A] | [A] | [A] | 1.9 | 8QV:(5S)-3-(3,6-DIHYDRO-2H-PYRAN-4-YL)-7-[5-(PROP-1-YN-1-YL)PYRIDIN-3-YL]-5___sq___H-SPIRO[1-BENZOPYRANO[2,3-C]PYRIDINE-5,4___sq___-[1,3]OXAZOL]-2___sq___-AMINE GOL:GLYCEROL IOD:IODIDE ION | |||
5v0n | [A] | [A] | [A] | 2.16 | 8W4:N-{(1S,2S)-1-[(2S)-4-BENZYL-3-OXOPIPERAZIN-2-YL]-1-HYDROXY-3-PHENYLPROPAN-2-YL}-7-ETHYL-1,3,3-TRIMETHYL-2,2-DIOXO-1,2,3,4-TETRAHYDRO-2LAMBDA~6~-[1,2,5]THIADIAZEPINO[3,4,5-HI]INDOLE-9-CARBOXAMIDE GOL:GLYCEROL SO4:SULFATE ION URE:UREA | |||
5v4y | [A2] | [A2] | [A2] | 1.9 | 8FM:(3S,3AR,5R,7AS,8S)-HEXAHYDRO-4H-3,5-METHANOFURO[2,3-B]PYRAN-8-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE | |||
5v8v | [A] | [A] | [A] | 2.6 | 90D:METHYL [(4S)-4-(3___sq___-ETHYL-6-FLUORO[1,1___sq___-BIPHENYL]-2-YL)-4-HYDROXY-4-{(3R)-1-[4-(METHYLAMINO)BUTANOYL]PIPERIDIN-3-YL}BUTYL]CARBAMATE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE | |||
5vck | [A2] | [A2] | [A2] | 1.8 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE 7GC:4-METHYL-N-(THIAZOL-2-YLCARBAMOYL)BENZENESULFONAMIDE | |||
5vea | [A2] | [A2] | [A2] | 2 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE 9AY:4-METHYLBENZENE-1,2-DIAMINE DMS:DIMETHYL SULFOXIDE | |||
5vj3 | [A2] | [A2] | [A2] | 2 | HV9:4-METHYL-N-({1-[4-(TRIFLUOROMETHYL)PYRIMIDIN-2-YL]PIPERIDIN-4-YL}CARBAMOYL)BENZENE-1-SULFONAMIDE MG:MAGNESIUM ION | |||
5vpm | [A] | [A] | [A] | 2.9 | 9G7:METHYL [(4S)-4-(3___sq___-ETHYL-6-FLUORO[1,1___sq___-BIPHENYL]-2-YL)-4-HYDROXY-4-{(3R)-1-[(PIPERIDIN-4-YL)ACETYL]PIPERIDIN-3-YL}BUTYL]CARBAMATE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
5vrp | [A] | [A] | [A] | 3.22 | 9JD:METHYL [(4S)-4-{(3R)-1-[(3S)-4-AMINO-3-HYDROXYBUTANOYL]PIPERIDIN-3-YL}-4-(3___sq___-ETHYL-6-FLUORO[1,1___sq___-BIPHENYL]-2-YL)-4-HYDROXYBUTYL]CARBAMATE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
5w5w | [A2] | [A2] | [A2] | 3 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE DMS:DIMETHYL SULFOXIDE HV9:4-METHYL-N-({1-[4-(TRIFLUOROMETHYL)PYRIMIDIN-2-YL]PIPERIDIN-4-YL}CARBAMOYL)BENZENE-1-SULFONAMIDE | |||
5wlo | [A2] | [A2] | [A2] | 1.27 | ACT:ACETATE ION CL:CHLORIDE ION GOL:GLYCEROL GR7:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL {(2S,3R)-3-HYDROXY-4-[(7E)-13-METHOXY-1,1-DIOXO-1,4,5,6,9,11-HEXAHYDRO-10,1LAMBDA~6~,2-BENZOXATHIAZACYCLOTRIDECIN-2(3H)-YL]-1-PHENYLBUTAN-2-YL}CARBAMATE NA:SODIUM ION | |||
5ygx | [A] | [A] | [A] | 2.2 | 0B5:~{N}-[3-[(4~{R},5~{R},6~{S})-2-AZANYL-6-[1,1-BIS(FLUORANYL)ETHYL]-5-FLUORANYL-4-METHYL-5,6-DIHYDRO-1,3-OXAZIN-4-YL]-4-FLUORANYL-PHENYL]-5-(FLUORANYLMETHOXY)PYRAZINE-2-CARBOXAMIDE DMS:DIMETHYL SULFOXIDE GOL:GLYCEROL IOD:IODIDE ION | |||
5ygy | [A] | [A] | [A] | 2.3 | 0B6:~{N}-[3-[(4~{S})-2-AZANYL-6-(FLUORANYLMETHYL)-4-METHYL-1,3-OXAZIN-4-YL]-4-FLUORANYL-PHENYL]-5-CYANO-PYRIDINE-2-CARBOXAMIDE GOL:GLYCEROL IOD:IODIDE ION | |||
5yia | [A] | [A] | [A] | 2 | 8V9:(4R)-3-[(2S,3S)-3-[[(2R)-2-[2-(4-HYDROXYPHENYL)ETHANOYLAMINO]-3-METHYLSULFANYL-PROPANOYL]AMINO]-2-OXIDANYL-4-PHENYL-BUTANOYL]-5,5-DIMETHYL-N-[(1S,2R)-2-OXIDANYL-2,3-DIHYDRO-1H-INDEN-1-YL]-1,3-THIAZOLIDINE-4-CARBOXAMIDE CPS:3-[(3-CHOLAMIDOPROPYL)DIMETHYLAMMONIO]-1-PROPANESULFONATE GOL:GLYCEROL PO4:PHOSPHATE ION | |||
5yib | [A] | [A] | [A] | 2.15 | 8VC:(4R)-3-[(2S,3S)-3-[2-[4-[2-(DIMETHYLAMINO)ETHYL-METHYL-AMINO]-2,6-DIMETHYL-PHENOXY]ETHANOYLAMINO]-2-OXIDANYL-4-PHENYL-BUTANOYL]-5,5-DIMETHYL-N-[(1S,2R)-2-OXIDANYL-2,3-DIHYDRO-1H-INDEN-1-YL]-1,3-THIAZOLIDINE-4-CARBOXAMIDE CPS:3-[(3-CHOLAMIDOPROPYL)DIMETHYLAMMONIO]-1-PROPANESULFONATE EDO:1,2-ETHANEDIOL GOL:GLYCEROL | |||
5yic | [A] | [A] | [A] | 1.9 | 8VO:(4R)-3-[(2S,3S)-3-[[(2R)-2-[2-(4-AMINOPHENYL)ETHANOYLAMINO]-3-METHYLSULFANYL-PROPANOYL]AMINO]-2-OXIDANYL-4-PHENYL-BUTANOYL]-5,5-DIMETHYL-N-[(1S,2R)-2-OXIDANYL-2,3-DIHYDRO-1H-INDEN-1-YL]-1,3-THIAZOLIDINE-4-CARBOXAMIDE CPS:3-[(3-CHOLAMIDOPROPYL)DIMETHYLAMMONIO]-1-PROPANESULFONATE GOL:GLYCEROL | |||
5yid | [A] | [A] | [A] | 2.1 | CPS:3-[(3-CHOLAMIDOPROPYL)DIMETHYLAMMONIO]-1-PROPANESULFONATE K95:(4R)-N-[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]-3-[(2S,3S)-2-HYDROXY-3-{[S-METHYL-N-(PHENYLACETYL)-L-CYSTEINYL]AMINO}-4-PHENYLBUTANOYL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE NA:SODIUM ION | |||
5yie | [A] | [A] | [A] | 2.1 | 8VF:(4R)-3-[(2S,3S)-3-[2-[4-[2-AZANYLETHYL(ETHYL)AMINO]-2,6-DIMETHYL-PHENOXY]ETHANOYLAMINO]-2-OXIDANYL-4-PHENYL-BUTANOYL]-5,5-DIMETHYL-N-[(1S,2R)-2-OXIDANYL-2,3-DIHYDRO-1H-INDEN-1-YL]-1,3-THIAZOLIDINE-4-CARBOXAMIDE CPS:3-[(3-CHOLAMIDOPROPYL)DIMETHYLAMMONIO]-1-PROPANESULFONATE NA:SODIUM ION | |||
5yoj | [A2] | [A2] | [A2] | 1.5 | 8Z0:(4R)-N-[(2,6-DIMETHYLPHENYL)METHYL]-3-[(2S,3S)-3-[[(2S)-2-[(7-METHOXY-1-BENZOFURAN-2-YL)CARBONYLAMINO]-2-[(3R)-OXOLAN-3-YL]ETHANOYL]AMINO]-2-OXIDANYL-4-PHENYL-BUTANOYL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE GOL:GLYCEROL | |||
5yok | [A2] | [A2] | [A2] | 0.85 | 8Z0:(4R)-N-[(2,6-DIMETHYLPHENYL)METHYL]-3-[(2S,3S)-3-[[(2S)-2-[(7-METHOXY-1-BENZOFURAN-2-YL)CARBONYLAMINO]-2-[(3R)-OXOLAN-3-YL]ETHANOYL]AMINO]-2-OXIDANYL-4-PHENYL-BUTANOYL]-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXAMIDE GOL:GLYCEROL | |||
5yq8 | [A2] | [A2] | [A2] | 2.25 | ||||
5yrs | [AB][a] | [AB][a] | [A2][a] | 1.76 | HPH:(2S)-2-AMINO-3-PHENYLPROPANE-1,1-DIOL | |||
5ys4 | [A2] | [A2] | [A2] | 2.3 | ||||
6apr | [A][a] | [A][a] | [A][a] | 2.5 | IVA:ISOVALERIC ACID STA:STATINE | |||
6b36 | [A2] | [A2] | [A2] | 1.63 | CKD:(S)-N-(3-FLUORO-2-(2-(1-(PHENYLSULFONYL)PIPERAZIN-2-YL)ETHYL)PHENYL)-3,3-BIS(4-FLUOROPHENYL)PROPANAMIDE CL:CHLORIDE ION | |||
6b38 | [A2] | [A2] | [A2] | 1.48 | CKM:N-(3-FLUORO-2-{2-[(2S,6R)-6-METHYL-1-(PHENYLSULFONYL)PIPERAZIN-2-YL]ETHYL}PHENYL)-3,3-BIS(4-FLUOROPHENYL)PROPANAMIDE CL:CHLORIDE ION | |||
6b3c | [A2] | [A2] | [A2] | 1.6 | CKS:N-(3-FLUORO-2-{2-[(2S,5R)-5-METHYL-1-(PHENYLSULFONYL)PIPERAZIN-2-YL]ETHYL}PHENYL)-3,3-BIS(4-FLUOROPHENYL)PROPANAMIDE CL:CHLORIDE ION | |||
6b3f | [A2] | [A2] | [A2] | 1.46 | CKV:N-(3-FLUORO-2-{2-[(2S,5S)-5-METHYL-1-(PHENYLSULFONYL)PIPERAZIN-2-YL]ETHYL}PHENYL)-3,3-BIS(4-FLUOROPHENYL)PROPANAMIDE CL:CHLORIDE ION | |||
6b3g | [A2] | [A2] | [A2] | 1.5 | CKY:N-(3-FLUORO-2-{2-[(2S,6S)-6-METHYL-1-(PHENYLSULFONYL)PIPERAZIN-2-YL]ETHYL}PHENYL)-3,3-BIS(4-FLUOROPHENYL)PROPANAMIDE CL:CHLORIDE ION | |||
6b3h | [A2] | [A2] | [A2] | 1.62 | CL:CHLORIDE ION CN4:N-(2-{2-[(6R,9S)-2,2-DIOXO-2LAMBDA~6~-THIA-1,7-DIAZABICYCLO[4.3.1]DECAN-9-YL]ETHYL}-3-FLUOROPHENYL)-3,3-BIS(4-FLUOROPHENYL)PROPANAMIDE | |||
6b4n | [A2] | [A2] | [A2] | 1.3 | CL:CHLORIDE ION G53:METHYL 2-{4-[{(2R,3S)-3-[({[(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL]OXY}CARBONYL)AMINO]-2-HYDROXY-4-PHENYLBUTYL}(2-METHYLPROPYL)SULFAMOYL]PHENYL}-1,3-OXAZOLE-4-CARBOXYLATE NA:SODIUM ION | |||
6bfd | [A] | [A] | [A] | 1.62 | DJS:2-{[(2S)-BUTAN-2-YL]AMINO}-N-{(1R,2S)-1-HYDROXY-3-PHENYL-1-[(2R)-PYRROLIDIN-2-YL]PROPAN-2-YL}-6-(METHYLSULFONYL)PYRIDINE-4-CARBOXAMIDE GOL:GLYCEROL | |||
6bfe | [A] | [A] | [A] | 1.51 | DJV:N-[(1R,2S)-1-[(2R,4R)-4-(CYCLOHEXYLMETHOXY)PYRROLIDIN-2-YL]-3-(3,5-DIFLUOROPHENYL)-1-HYDROXYPROPAN-2-YL]ACETAMIDE GOL:GLYCEROL | |||
6bfw | [A] | [A] | [A] | 1.84 | DK7:N-[(1S,2S)-1-[(3R,6R)-6-(CYCLOHEXYLMETHOXY)MORPHOLIN-3-YL]-3-(3,5-DIFLUOROPHENYL)-1-HYDROXYPROPAN-2-YL]ACETAMIDE GOL:GLYCEROL | |||
6bfx | [A] | [A] | [A] | 1.99 | DKJ:N-{(1S,2S)-3-(3,5-DIFLUOROPHENYL)-1-[(3R,5S,6R)-6-(2,2-DIMETHYLPROPOXY)-5-METHYLMORPHOLIN-3-YL]-1-HYDROXYPROPAN-2-YL}ACETAMIDE GOL:GLYCEROL | |||
6bra | [A2][a] | [A2][a] | [A2][a] | 1.11 | CL:CHLORIDE ION | |||
6bz2 | [A2] | [A2] | [A2] | 1.67 | 7OA:(3S,3AR,5R,7AS,8S)-HEXAHYDRO-4H-3,5-METHANOFURO[2,3-B]PYRAN-8-YL [(2S,3R)-4-[{[2-(CYCLOPROPYLAMINO)-1,3-BENZOTHIAZOL-6-YL]SULFONYL}(2-METHYLPROPYL)AMINO]-1-(3,5-DIFLUOROPHENYL)-3-HYDROXYBUTAN-2-YL]CARBAMATE ACT:ACETATE ION CL:CHLORIDE ION NA:SODIUM ION | |||
6c2i | [A] | [A] | [A] | 1.95 | EJ7:N-{3-[(1R,5S,6R)-3-AMINO-5-METHYL-2-OXA-4-AZABICYCLO[4.1.0]HEPT-3-EN-5-YL]-4-FLUOROPHENYL}-5-METHOXYPYRAZINE-2-CARBOXAMIDE GOL:GLYCEROL IOD:IODIDE ION SO4:SULFATE ION | |||
6c8x | [A2] | [A2] | [A2] | 1.61 | BVR:[4-[[(2~{R},3~{S})-3-[[(3~{A}~{S},4~{R},6~{A}~{R})-2,3,3~{A},4,5,6~{A}-HEXAHYDROFURO[2,3-B]FURAN-4-YL]OXYCARBONYLAMINO]-2-OXIDANYL-4-PHENYL-BUTYL]-(2-METHYLPROPYL)SULFAMOYL]PHENYL]-OXIDANYL-OXIDANYLIDENE-BORON CL:CHLORIDE ION GOL:GLYCEROL | |||
6c8y | [A2] | [A2] | [A2] | 1.94 | BVR:[4-[[(2~{R},3~{S})-3-[[(3~{A}~{S},4~{R},6~{A}~{R})-2,3,3~{A},4,5,6~{A}-HEXAHYDROFURO[2,3-B]FURAN-4-YL]OXYCARBONYLAMINO]-2-OXIDANYL-4-PHENYL-BUTYL]-(2-METHYLPROPYL)SULFAMOYL]PHENYL]-OXIDANYL-OXIDANYLIDENE-BORON CL:CHLORIDE ION GOL:GLYCEROL | |||
6cdj | [A2] | [A2] | [A2] | 1.13 | ACT:ACETATE ION CL:CHLORIDE ION GOL:GLYCEROL GR8:(2AS,4R,4AS,7AS,7BS)-OCTAHYDRO-2H-1,7-DIOXACYCLOPENTA[CD]INDEN-4-YL [(2S,3R)-4-[{[2-(CYCLOPROPYLAMINO)-1,3-BENZOTHIAZOL-6-YL]SULFONYL}(2-METHYLPROPYL)AMINO]-1-(3,5-DIFLUOROPHENYL)-3-HYDROXYBUTAN-2-YL]CARBAMATE NA:SODIUM ION | |||
6cdl | [A2] | [A2] | [A2] | 1.25 | ACT:ACETATE ION CL:CHLORIDE ION GOL:GLYCEROL GR5:(2AR,4S,4AR,7AR,7BR)-OCTAHYDRO-2H-1,7-DIOXACYCLOPENTA[CD]INDEN-4-YL [(2S,3R)-4-[{[2-(CYCLOPROPYLAMINO)-1,3-BENZOTHIAZOL-6-YL]SULFONYL}(2-METHYLPROPYL)AMINO]-1-(3,5-DIFLUOROPHENYL)-3-HYDROXYBUTAN-2-YL]CARBAMATE NA:SODIUM ION | |||
6d0d | [A2] | [A2] | [A2] | 1.85 | FQ4:(3AS,4S,7AR)-HEXAHYDRO-4H-FURO[2,3-B]PYRAN-4-YL [(2S,3R)-1-(4-FLUOROPHENYL)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}BUTAN-2-YL]CARBAMATE | |||
6d0e | [A2] | [A2] | [A2] | 1.95 | FQ1:(3AS,4S,7AR)-HEXAHYDRO-4H-FURO[2,3-B]PYRAN-4-YL [(2S,3R)-1-(3,5-DIFLUOROPHENYL)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}BUTAN-2-YL]CARBAMATE | |||
6dgx | [A2] | [A2] | [A2] | 2 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE SO4:SULFATE ION | |||
6dgy | [A2] | [A2] | [A2] | 1.95 | K13:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-{[(4-AMINOPHENYL)SULFONYL][(2S)-2-METHYLBUTYL]AMINO}-1-BENZYL-2-HYDROXYPROPYL]CARBAMATE SO4:SULFATE ION | |||
6dgz | [A2] | [A2] | [A2] | 1.99 | A60:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-{[(4-AMINOPHENYL)SULFONYL](2-ETHYLBUTYL)AMINO}-1-BENZYL-2-HYDROXYPROPYL]CARBAMATE SO4:SULFATE ION | |||
6dh0 | [A2] | [A2] | [A2] | 1.9 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | |||
6dh1 | [A2] | [A2] | [A2] | 1.97 | K13:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-{[(4-AMINOPHENYL)SULFONYL][(2S)-2-METHYLBUTYL]AMINO}-1-BENZYL-2-HYDROXYPROPYL]CARBAMATE SO4:SULFATE ION | |||
6dh2 | [A2] | [A2] | [A2] | 1.98 | A60:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-{[(4-AMINOPHENYL)SULFONYL](2-ETHYLBUTYL)AMINO}-1-BENZYL-2-HYDROXYPROPYL]CARBAMATE SO4:SULFATE ION | |||
6dh3 | [A2] | [A2] | [A2] | 1.91 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE SO4:SULFATE ION | |||
6dh4 | [A2] | [A2] | [A2] | 1.94 | K13:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-{[(4-AMINOPHENYL)SULFONYL][(2S)-2-METHYLBUTYL]AMINO}-1-BENZYL-2-HYDROXYPROPYL]CARBAMATE SO4:SULFATE ION | |||
6dh5 | [A2] | [A2] | [A2] | 2.01 | A60:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-{[(4-AMINOPHENYL)SULFONYL](2-ETHYLBUTYL)AMINO}-1-BENZYL-2-HYDROXYPROPYL]CARBAMATE SO4:SULFATE ION | |||
6dh6 | [A2] | [A2] | [A2] | 1.97 | 017:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE SO4:SULFATE ION | |||
6dh7 | [A2] | [A2] | [A2] | 2 | K13:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-{[(4-AMINOPHENYL)SULFONYL][(2S)-2-METHYLBUTYL]AMINO}-1-BENZYL-2-HYDROXYPROPYL]CARBAMATE SO4:SULFATE ION | |||
6dh8 | [A2] | [A2] | [A2] | 1.95 | A60:(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-{[(4-AMINOPHENYL)SULFONYL](2-ETHYLBUTYL)AMINO}-1-BENZYL-2-HYDROXYPROPYL]CARBAMATE SO4:SULFATE ION | |||
6dhc | [A] | [A] | [A] | 2.85 | GHJ:(3R,3AR,6AS)-N-[(4R,7S,8S,10R,13S)-8-HYDROXY-10,17-DIMETHYL-7-(2-METHYLPROPYL)-5,11,14-TRIOXO-13-(PROPAN-2-YL)-2-THIA-6,12,15-TRIAZAOCTADECAN-4-YL]HEXAHYDROFURO[3,2-D][1,2]OXAZOLE-3-CARBOXAMIDE GOL:GLYCEROL SO4:SULFATE ION URE:UREA | |||
6dif | [A2] | [A2] | [A2] | 1.2 | CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION TPV:N-(3-{(1R)-1-[(6R)-4-HYDROXY-2-OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO-2H-PYRAN-3-YL]PROPYL}PHENYL)-5-(TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE | |||
6dil | [A2] | [A2] | [A2] | 1.48 | ACT:ACETATE ION CL:CHLORIDE ION GOL:GLYCEROL NA:SODIUM ION TPV:N-(3-{(1R)-1-[(6R)-4-HYDROXY-2-OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO-2H-PYRAN-3-YL]PROPYL}PHENYL)-5-(TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE | |||
6dj1 | [A2] | [A2] | [A2] | 1.26 | AB1:N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE CL:CHLORIDE ION NA:SODIUM ION | |||
6dj2 | [A2] | [A2] | [A2] | 1.36 | AB1:N-{1-BENZYL-4-[2-(2,6-DIMETHYL-PHENOXY)-ACETYLAMINO]-3-HYDROXY-5-PHENYL-PENTYL}-3-METHYL-2-(2-OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-BUTYRAMIDE CL:CHLORIDE ION NA:SODIUM ION | |||
6dj5 | [A2] | [A2] | [A2] | 1.75 | CL:CHLORIDE ION G52:(3R,3AS,3BR,6AS,7AS)-OCTAHYDRODIFURO[2,3-B:3___sq___,2___sq___-D]FURAN-3-YL [(1S,2R)-1-BENZYL-2-HYDROXY-3-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}PROPYL]CARBAMATE GOL:GLYCEROL NA:SODIUM ION | |||
6dj7 | [A2] | [A2] | [A2] | 1.31 | ACT:ACETATE ION CL:CHLORIDE ION G10:(3R,3AS,6AS)-4,4-DIFLUOROHEXAHYDROFURO[2,3-B]FURAN-3-YL[(2S,3R)-4-{[(4-AMINOPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-3-HYDROXY-1-PHENYLBUTAN-2-YL]CARBAMATE GOL:GLYCEROL NA:SODIUM ION | |||
6dmi | [A] | [A] | [A] | 1.9 | 5T5:[(1~{R},2~{R})-2-[(4~{S})-2-AZANYL-4-[4-[BIS(FLUORANYL)METHOXY]PHENYL]-5~{H}-1,3-OXAZOL-4-YL]CYCLOPROPYL]-(5-CHLORANYLPYRIDIN-3-YL)METHANONE DMS:DIMETHYL SULFOXIDE NA:SODIUM ION | |||
6dv0 | [A2] | [A2] | [A2] | 1.2 | CL:CHLORIDE ION GA8:TERT-BUTYL [(4S)-6-{[(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMOYL}-3,4-DIHYDRO-2H-1-BENZOTHIOPYRAN-4-YL]CARBAMATE GOL:GLYCEROL NA:SODIUM ION | |||
6dv4 | [A2] | [A2] | [A2] | 1.14 | ACT:ACETATE ION CL:CHLORIDE ION GA5:TERT-BUTYL [(1R,4S)-4-HYDROXY-7-{[(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMOYL}-1,2,3,4-TETRAHYDRONAPHTHALEN-1-YL]CARBAMATE GOL:GLYCEROL NA:SODIUM ION | |||
6e7j | [A2] | [A2] | [A2] | 1.3 | CL:CHLORIDE ION HWY:(3AS,5R,6AR)-2-OXO-3-PHENYLHEXAHYDRO-2H-CYCLOPENTA[D][1,3]OXAZOL-5-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE NA:SODIUM ION | |||
6e9a | [A2] | [A2] | [A2] | 1.22 | CL:CHLORIDE ION FMT:FORMIC ACID J0S:(3AS,5R,6AR)-2-OXOHEXAHYDRO-2H-CYCLOPENTA[D][1,3]OXAZOL-5-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE NA:SODIUM ION | |||
6ej2 | [A] | [A] | [A] | 1.46 | B7E:COMPOUND 28 | |||
6ej3 | [A] | [A] | [A] | 1.94 | B7T:(1R,4R)-4-METHOXY-6___sq___-(5-METHYL-3-PYRIDINYL)-3___sq___H-DISPIRO[CYCLOHEXANE-1,2___sq___-INDENE-1___sq___,4___sq______sq___-[1,3]OXAZOL]-2___sq______sq___-AMINE | |||
6eqm | [A] | [A] | [A] | 1.35 | BUH:~{N}-[6-[(3~{R},6~{R})-5-AZANYL-3,6-DIMETHYL-6-(TRIFLUOROMETHYL)-2~{H}-1,4-OXAZIN-3-YL]-5-FLUORANYL-PYRIDIN-2-YL]-3-CHLORANYL-5-(TRIFLUOROMETHYL)PYRIDINE-2-CARBOXAMIDE | |||
6fgy | [A] | [A] | [A] | 1.54 | D9W:~{N}-[3-[(3~{R})-5-AZANYL-3-METHYL-2,6-DIHYDRO-1,4-OXAZIN-3-YL]PHENYL]-5-BROMANYL-PYRIDINE-2-CARBOXAMIDE | |||
6fiv | [A2] | [A2] | [A2] | 1.9 | 3TL:BENZYL [(1S,4S,7S,8R,9R,10S,13S,16S)-7,10-DIBENZYL-8,9-DIHYDROXY-1,16-DIMETHYL-4,13-BIS(1-METHYLETHYL)-2,5,12,15,18-PENTAOXO-20-PHENYL-19-OXA-3,6,11,14,17-PENTAAZAICOS-1-YL]CARBAMATE SO4:SULFATE ION | |||
6i3f | [AB] | [AB] | [AB] | 2.55 | BMA:BETA-D-MANNOPYRANOSE FUC:ALPHA-L-FUCOPYRANOSE GOL:GLYCEROL MAN:ALPHA-D-MANNOPYRANOSE NAG:2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE SO4:SULFATE ION | |||
6ixd | [A2] | [A2] | [A2] | 1 | B0F:(4R)-3-[(2S,3S)-3-[2-[4-[5-[(3AS,4S,6AR)-2-OXIDANYLIDENE-1,3,3A,4,6,6A-HEXAHYDROTHIENO[3,4-D]IMIDAZOL-4-YL]PENTANOYLAMINO]-2,6-DIMETHYL-PHENOXY]ETHANOYLAMINO]-2-OXIDANYL-4-PHENYL-BUTANOYL]-5,5-DIMETHYL-N-[(1S,2R)-2-OXIDANYL-2,3-DIHYDRO-1H-INDEN-1-YL]-1,3-THIAZOLIDINE-4-CARBOXAMIDE CL:CHLORIDE ION GOL:GLYCEROL SO4:SULFATE ION | |||
6mcr | [A2] | [A2] | [A2] | 1.48 | EDO:1,2-ETHANEDIOL JDY:(3S,3AR,5R,7AS,8S)-HEXAHYDRO-4H-3,5-METHANOFURO[2,3-B]PYRAN-8-YL [(2S,3R)-4-[{[2-(CYCLOPROPYLAMINO)-1,3-BENZOTHIAZOL-6-YL]SULFONYL}(2-METHYLPROPYL)AMINO]-1-(3-FLUOROPHENYL)-3-HYDROXYBUTAN-2-YL]CARBAMATE | |||
6mcs | [A2] | [A2] | [A2] | 1.52 | JDV:(3S,3AR,5R,7AS,8S)-HEXAHYDRO-4H-3,5-METHANOFURO[2,3-B]PYRAN-8-YL [(2S,3R)-4-[{[2-(CYCLOPROPYLAMINO)-1,3-BENZOTHIAZOL-6-YL]SULFONYL}(2-METHYLPROPYL)AMINO]-1-(4-FLUOROPHENYL)-3-HYDROXYBUTAN-2-YL]CARBAMATE | |||
6otg | [A2] | [A2] | [A2] | 1.5 | 4UY:(3R,3AS,4R,6AR)-4-(METHYLAMINO)HEXAHYDROFURO[2,3-B]FURAN-3-YL [(2S,3R)-3-HYDROXY-4-{[(4-METHOXYPHENYL)SULFONYL](2-METHYLPROPYL)AMINO}-1-PHENYLBUTAN-2-YL]CARBAMATE FMT:FORMIC ACID GOL:GLYCEROL | |||
6upj | [A2] | [A2] | [A2] | 2.34 | NIU:6,7,8,9-TETRAHYDRO-4-HYDROXY-3-(1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN-2-ONE | |||
7hvp | [A2][a] | [A2][a] | [A2][a] | 2.4 | ABA:ALPHA-AMINOBUTYRIC ACID ACE:ACETYL GROUP JG3:1-[(2S,3S)-3-AMINO-2-HYDROXY-4-PHENYLBUTYL]-L-PROLINE VME:METHYL L-VALINATE | |||
7upj | [A2] | [A2] | [A2] | 2 | INU:N-(3-CYCLOPROPYL(5,6,7,8,9,10-HEXAHYDRO-2-OXO-2H-CYCLOOCTA[B]PYRAN-3-YL)METHYL)PHENYLBENZENSULFONAMIDE | |||
8hvp | [A2][a] | [A2][a] | [A2][a] | 2.5 | ABA:ALPHA-AMINOBUTYRIC ACID LOV:5-AMINO-4-HYDROXY-2-ISOPROPYL-7-METHYL-OCTANOIC ACID | |||
9hvp | [A2] | [A2] | [A2] | 2.8 | 0E9:BENZYL [(1R,4S,6S,9R)-4,6-DIBENZYL-5-HYDROXY-1,9-BIS(1-METHYLETHYL)-2,8,11-TRIOXO-13-PHENYL-12-OXA-3,7,10-TRIAZATRIDEC-1-YL]CARBAMATE |
*Chain Formula of OLIGAMI.
[ ] : Polypeptide - [AB] : Protein, [ab] : Small peptide
( ) : Nucleic acid - (AB) : DNA, (ab) : RNA
[ ] : Polypeptide - [AB] : Protein, [ab] : Small peptide
( ) : Nucleic acid - (AB) : DNA, (ab) : RNA