PDB ID : 4nmh [A2]

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 a AR:All Residues
 b IR:Interface Residues

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Secondary Structure


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Chain

Chain name Ribbon Spacefill Cαonly
OLIGAMI PDB
AA
BB
Title
11-BETA-HSD1 IN COMPLEX WITH A 3,3-DI-METHYL-AZETIDIN-2-ONE

Structure Summary
PDB ID Mutant OPM Pub Med Method/Resolution HETNAM
4nmh
Not in PubMed X-RAY DIFFRACTION/2.9 2KG:(4S)-4-(2-METHOXYPHENYL)-3,3-DIMETHYL-1-[3-(METHYLSULFONYL)PHENYL]AZETIDIN-2-ONE
NDP:NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDEPHOSPHATE
SO4:SULFATE ION
Chain Formula
Amino Acid sequence SCOPe Family Level CATH Homology Level
[A2] [A2] [A2]

Interfaces
Interface ID Chain Inaterface
Class
Interface Type Contact Type
4nmh_AB A
B
HN
HN
i7_CR(H35,N24)_HH(A1,S4)_HN(L3,S9)
i7_CR(H35,N24)_HH(A1,S4)_HN(L3,S9)
c4_RP(HH52,NN42,HN39,NH36,EN1)_HH(P2,A3,S6)_HN(L8,S9)
c4_RP(HH52,NN42,HN39,NH36,EN1)_HH(P2,A3,S6)_HN(L8,S9)

Interface Class
Interface ID Interface 1 Interface 2
Domain Number of contact residues Binding site Class Percentages of Secondary structures(%) Domain Number of contact residues Binding site Class Percentages of Secondary structures(%)
H E N H E N
4nmh_AB A 57 HN 52.6 100 47.4 B 57 HN 50.9 0 49.1

Interface Type: Information for each interface
Interface ID chain Number of contact residues Number of elements Number of contacts between Secondary structure elements
HH EE HE HN EN
Hn En Nn H E N R L P A S P A S Ph Ah Ih P A S L S L S
4nmh_AB A 30 57 27 6 0 7 0 0 0 0 4 0 0 0 0 0 0 0 0 0 3 10 0 0
4nmh_AB B 29 0 28 6 0 7 0 0 0 0 3 0 0 0 0 0 0 0 0 0 2 12 0 0

Contact Type: Information of contacts between interfaces
Interface ID Number of residue pairs between SS elements Number of contacts between Secondary structure elements
H-H E-E N-N H-E H-N N-E E-H N-H E-N H-H E-E H-E H-N E-N
P A S Ih P A S IPh IAh P A S Ih L S Ih L S Ih
4nmh_AB 45 0 37 0 36 0 0 35 0 0 3 7 0 0 0 0 0 0 0 0 0 0 8 8 0 0 0 0

Structual Classification
SCOPe
SCOPe ID Chain Class Fold Superfamily Family Protein Domain Species
238031 A:Alpha and beta proteins (a/b)NAD(P)-binding Rossmann-fold domainsNAD(P)-binding Rossmann-fold domainsTyrosine-dependent oxidoreductases11-beta-hydroxysteroid dehydrogenase 1Mouse (Mus musculus) [TaxId: 10090]
238030 B:Alpha and beta proteins (a/b)NAD(P)-binding Rossmann-fold domainsNAD(P)-binding Rossmann-fold domainsTyrosine-dependent oxidoreductases11-beta-hydroxysteroid dehydrogenase 1Mouse (Mus musculus) [TaxId: 10090]
240636 C:Alpha and beta proteins (a/b)NAD(P)-binding Rossmann-fold domainsNAD(P)-binding Rossmann-fold domainsTyrosine-dependent oxidoreductases11-beta-hydroxysteroid dehydrogenase 1Mouse (Mus musculus) [TaxId: 10090]
240637 D:Alpha and beta proteins (a/b)NAD(P)-binding Rossmann-fold domainsNAD(P)-binding Rossmann-fold domainsTyrosine-dependent oxidoreductases11-beta-hydroxysteroid dehydrogenase 1Mouse (Mus musculus) [TaxId: 10090]

CATH
CATH ID Node Class Architecture Topology Homology
4nmhA003.40.50.720:3-Layer(aba) Sandwich:Rossmann fold:NAD(P)-binding Rossmann-like Domain
4nmhB003.40.50.720:3-Layer(aba) Sandwich:Rossmann fold:NAD(P)-binding Rossmann-like Domain
4nmhC003.40.50.720:3-Layer(aba) Sandwich:Rossmann fold:NAD(P)-binding Rossmann-like Domain
4nmhD003.40.50.720:3-Layer(aba) Sandwich:Rossmann fold:NAD(P)-binding Rossmann-like Domain