PDB ID : 4cod [A4]

Color

ARa IRb





 a AR:All Residues
 b IR:Interface Residues

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Secondary Structure


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Slab plane

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Chain
Chain name Ribbon Spacefill Cαonly
OLIGAMI PDB
AB
BF
CD
DH
Title
ENCODED LIBRARY TECHNOLOGY AS A SOURCE OF HITS FOR THE DISCOVERY AND LEAD OPTIMIZATION OF A POTENT AND SELECTIVE CLASS OF BACTERICIDAL DIRECT INHIBITORS OF MYCOBACTERIUM TUBERCULOSIS INHA

Structure Summary
PDB ID Mutant OPM Pub Med Method/Resolution HETNAM
4cod
24450589 X-RAY DIFFRACTION/2.4 KV1:N-((3R,5S)-1-(BENZOFURAN-3-CARBONYL)-5-(ETHYLCARBAMOYL)PYRROLIDIN-3-YL)-3-ETHYL-1-METHYL-1H-PYRAZOLE-5-CARBOXAMIDE
NAD:NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Chain Formula
Amino Acid sequence SCOPe Family Level CATH Homology Level
[A4] [A4] [A4]

Structual Classification
SCOPe
SCOPe ID Chain Class Fold Superfamily Family Protein Domain Species
236702 B:Alpha and beta proteins (a/b)NAD(P)-binding Rossmann-fold domainsNAD(P)-binding Rossmann-fold domainsTyrosine-dependent oxidoreductasesEnoyl-ACP reductaseMycobacterium tuberculosis, TB, gene InhA [TaxId: 1773]
236704 D:Alpha and beta proteins (a/b)NAD(P)-binding Rossmann-fold domainsNAD(P)-binding Rossmann-fold domainsTyrosine-dependent oxidoreductasesEnoyl-ACP reductaseMycobacterium tuberculosis, TB, gene InhA [TaxId: 1773]
236703 F:Alpha and beta proteins (a/b)NAD(P)-binding Rossmann-fold domainsNAD(P)-binding Rossmann-fold domainsTyrosine-dependent oxidoreductasesEnoyl-ACP reductaseMycobacterium tuberculosis, TB, gene InhA [TaxId: 1773]
236705 H:Alpha and beta proteins (a/b)NAD(P)-binding Rossmann-fold domainsNAD(P)-binding Rossmann-fold domainsTyrosine-dependent oxidoreductasesEnoyl-ACP reductaseMycobacterium tuberculosis, TB, gene InhA [TaxId: 1773]

CATH
CATH ID Node Class Architecture Topology Homology
4codB003.40.50.720:3-Layer(aba) Sandwich:Rossmann fold:NAD(P)-binding Rossmann-like Domain
4codD003.40.50.720:3-Layer(aba) Sandwich:Rossmann fold:NAD(P)-binding Rossmann-like Domain
4codF003.40.50.720:3-Layer(aba) Sandwich:Rossmann fold:NAD(P)-binding Rossmann-like Domain
4codH003.40.50.720:3-Layer(aba) Sandwich:Rossmann fold:NAD(P)-binding Rossmann-like Domain