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3MKI

Crystal Structure of Ketosteroid Isomerase D38ED99N from Pseudomonas Testosteroni (tKSI)

Functional Information from GO Data
ChainGOidnamespacecontents
A0004769molecular_functionsteroid delta-isomerase activity
A0008202biological_processsteroid metabolic process
A0016853molecular_functionisomerase activity
B0004769molecular_functionsteroid delta-isomerase activity
B0008202biological_processsteroid metabolic process
B0016853molecular_functionisomerase activity
C0004769molecular_functionsteroid delta-isomerase activity
C0008202biological_processsteroid metabolic process
C0016853molecular_functionisomerase activity
D0004769molecular_functionsteroid delta-isomerase activity
D0008202biological_processsteroid metabolic process
D0016853molecular_functionisomerase activity
Functional Information from PDB Data
site_idAC1
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 A 126
ChainResidue
AHIS6
AARG13

site_idAC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 A 127
ChainResidue
AHIS100
AARG102
ASER111
AARG113
AHOH147

site_idAC3
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 A 128
ChainResidue
AHOH155
AASN104
AGLY105

site_idAC4
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 A 129
ChainResidue
AHIS122
AALA123

site_idAC5
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 B 126
ChainResidue
BHIS122
BHOH146
BHOH186

site_idAC6
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 B 127
ChainResidue
BHIS100
BARG102
BSER111
BARG113
BHOH143

site_idAC7
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 B 128
ChainResidue
BTHR3
BGLU5
BHOH226
CMET1

site_idAC8
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 B 129
ChainResidue
BMET1
BASN76

site_idAC9
Number of Residues8
DetailsBINDING SITE FOR RESIDUE SO4 B 130
ChainResidue
BGLN12
BLEU67
BGLN69
BGLU70
BVAL71
BHIS122
BGLY124
BHOH197

site_idBC1
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 B 131
ChainResidue
BASN104
BGLY105

site_idBC2
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 B 132
ChainResidue
BARG91
BALA123
BHOH206
BHOH216
DARG91
DTHR93

site_idBC3
Number of Residues9
DetailsBINDING SITE FOR RESIDUE GOL B 133
ChainResidue
BGLU38
BTYR55
BSER58
BPHE82
BVAL84
BGOL134
BHOH153
BHOH160
DGLN89

site_idBC4
Number of Residues9
DetailsBINDING SITE FOR RESIDUE GOL B 134
ChainResidue
BGLU38
BPHE86
BPRO97
BPHE116
BGOL133
BHOH153
BHOH198
BHOH230
DGLN89

site_idBC5
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 C 126
ChainResidue
CHIS6
CARG13
CHOH205

site_idBC6
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 C 127
ChainResidue
CILE121
CHIS122
CALA123

site_idBC7
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 C 128
ChainResidue
CALA31
CASP32
CASN104
CLYS108
CHOH183
CHOH186

site_idBC8
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 C 129
ChainResidue
BHIS6
BARG13

site_idBC9
Number of Residues7
DetailsBINDING SITE FOR RESIDUE GOL C 130
ChainResidue
ALEU18
AGLU38
ATYR55
ASER58
ALEU63
AHOH190
CGLN89

site_idCC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE GOL C 131
ChainResidue
AGLN89
AHOH215
CGLU38
CPHE86
CPRO97
CHOH163

site_idCC2
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 D 126
ChainResidue
DHIS122
DALA123
DHOH158

site_idCC3
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 D 127
ChainResidue
CHOH187
DHIS6
DARG13
DHOH227

site_idCC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 D 128
ChainResidue
CLYS119
DGLN12
DGLU70
DVAL71
DHOH186

site_idCC5
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 D 129
ChainResidue
DHIS100
DARG102
DSER111
DARG113
DHOH143

site_idCC6
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 D 130
ChainResidue
DSER42
DGLU43

site_idCC7
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 D 131
ChainResidue
DASN104
DGLY105
DHOH145

site_idCC8
Number of Residues7
DetailsBINDING SITE FOR RESIDUE GOL D 132
ChainResidue
DTYR14
DGLU38
DSER58
DPHE82
DVAL84
DASN99
DHOH196

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues4
DetailsACT_SITE: Proton donor
ChainResidueDetails
ATYR14
BTYR14
CTYR14
DTYR14

site_idSWS_FT_FI2
Number of Residues4
DetailsACT_SITE: Proton acceptor => ECO:0000269|PubMed:3480517
ChainResidueDetails
AGLU38
BGLU38
CGLU38
DGLU38

site_idSWS_FT_FI3
Number of Residues4
DetailsBINDING:
ChainResidueDetails
AASN99
BASN99
CASN99
DASN99

224004

PDB entries from 2024-08-21

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