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4FJ2

Crystal structure of the ternary complex between a fungal 17beta-hydroxysteroid dehydrogenase (Holo form) and biochanin A

Functional Information from GO Data
ChainGOidnamespacecontents
A0000166molecular_functionnucleotide binding
A0016491molecular_functionoxidoreductase activity
A0016614molecular_functionoxidoreductase activity, acting on CH-OH group of donors
B0000166molecular_functionnucleotide binding
B0016491molecular_functionoxidoreductase activity
B0016614molecular_functionoxidoreductase activity, acting on CH-OH group of donors
C0000166molecular_functionnucleotide binding
C0016491molecular_functionoxidoreductase activity
C0016614molecular_functionoxidoreductase activity, acting on CH-OH group of donors
D0000166molecular_functionnucleotide binding
D0016491molecular_functionoxidoreductase activity
D0016614molecular_functionoxidoreductase activity, acting on CH-OH group of donors
Functional Information from PDB Data
site_idAC1
Number of Residues25
DetailsBINDING SITE FOR RESIDUE NAP A 301
ChainResidue
AGLY25
AARG78
AASN103
ASER104
AGLY105
ALEU126
ATHR151
ASER152
ATYR167
ALYS171
APRO197
AARG28
AGLY198
ATHR200
ATHR202
AASP203
AMET204
AHOH403
AGLY29
AILE30
AALA50
AASN51
ASER52
AASP76
AILE77

site_idAC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE EDO A 302
ChainResidue
AASN154
APHE159
AGLY199
ATYR212

site_idAC3
Number of Residues28
DetailsBINDING SITE FOR RESIDUE NAP B 301
ChainResidue
BGLY25
BARG28
BGLY29
BILE30
BTYR49
BALA50
BASN51
BSER52
BASP76
BILE77
BARG78
BASN103
BSER104
BGLY105
BLEU126
BTHR151
BSER152
BTYR167
BLYS171
BPRO197
BGLY198
BGLY199
BTHR200
BTHR202
BMET204
BQSO302
BHOH401
BHOH422

site_idAC4
Number of Residues15
DetailsBINDING SITE FOR RESIDUE QSO B 302
ChainResidue
BVAL107
BASN154
BTYR167
BGLY198
BGLY199
BMET204
BPHE205
BVAL208
BSER209
BTYR212
BILE213
BMET227
BALA228
BNAP301
BHOH435

site_idAC5
Number of Residues3
DetailsBINDING SITE FOR RESIDUE EDO B 303
ChainResidue
BLYS19
BGLY145
BVAL251

site_idAC6
Number of Residues30
DetailsBINDING SITE FOR RESIDUE NAP C 301
ChainResidue
CTHR202
CMET204
CHOH401
CHOH418
CHOH424
CHOH426
CGLY25
CARG28
CGLY29
CILE30
CTYR49
CALA50
CASN51
CSER52
CALA75
CASP76
CILE77
CARG78
CASN103
CSER104
CGLY105
CLEU126
CTHR151
CSER152
CTYR167
CLYS171
CPRO197
CGLY198
CGLY199
CTHR200

site_idAC7
Number of Residues4
DetailsBINDING SITE FOR RESIDUE EDO C 302
ChainResidue
CASN154
CPHE159
CGLY199
CHOH440

site_idAC8
Number of Residues4
DetailsBINDING SITE FOR RESIDUE EDO C 303
ChainResidue
CPHE124
CARG129
CHOH453
DPHE124

site_idAC9
Number of Residues27
DetailsBINDING SITE FOR RESIDUE NAP D 301
ChainResidue
DGLY25
DARG28
DGLY29
DILE30
DALA50
DASN51
DSER52
DASP76
DILE77
DARG78
DASN103
DSER104
DGLY105
DLEU126
DTHR151
DTYR167
DLYS171
DPRO197
DGLY198
DGLY199
DTHR200
DTHR202
DMET204
DQSO302
DHOH401
DHOH411
DHOH413

site_idBC1
Number of Residues14
DetailsBINDING SITE FOR RESIDUE QSO D 302
ChainResidue
DVAL106
DVAL107
DASN154
DTYR167
DGLY198
DGLY199
DPHE205
DVAL208
DSER209
DTYR212
DALA228
DNAP301
DHOH430
DHOH434

site_idBC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE EDO D 303
ChainResidue
DHIS211
DTYR212
DPRO214
DHOH460

Functional Information from PROSITE/UniProt
site_idPS00061
Number of Residues29
DetailsADH_SHORT Short-chain dehydrogenases/reductases family signature. NtskdfsvpkHslYSGSKGAVdSFVrIFS
ChainResidueDetails
AASN154-SER182

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PDB entries from 2024-07-24

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