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3WCZ

Crystal structure of Bombyx mori aldo-keto reductase (AKR2E4) in complex with NADP

Functional Information from GO Data
ChainGOidnamespacecontents
A0004032molecular_functionaldose reductase (NADPH) activity
A0005829cellular_componentcytosol
A0006629biological_processlipid metabolic process
A0008202biological_processsteroid metabolic process
A0016491molecular_functionoxidoreductase activity
Functional Information from PDB Data
site_idAC1
Number of Residues34
DetailsBINDING SITE FOR RESIDUE NAP A 401
ChainResidue
AGLY22
AASN159
AGLN180
ATYR206
ASER207
APRO208
APHE209
AVAL213
AARG215
AILE257
APRO258
ATHR23
ALYS259
ASER260
ATHR261
AARG265
AASN269
ACIT406
AHOH561
AHOH577
AHOH608
AHOH612
AGLY24
AHOH619
AHOH629
AHOH646
AHOH680
AHOH708
ATHR27
ALYS29
AASP53
ATYR58
AHIS120
ASER158

site_idAC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE EDO A 402
ChainResidue
ATYR173
AILE174
AARG175
AHOH653

site_idAC3
Number of Residues7
DetailsBINDING SITE FOR RESIDUE EDO A 403
ChainResidue
ATHR15
APRO17
AGLU80
AGLU81
ALEU82
AHOH647
AHOH691

site_idAC4
Number of Residues7
DetailsBINDING SITE FOR RESIDUE EDO A 404
ChainResidue
AASN74
ALEU76
AASN289
AASN291
AHOH651
AHOH655
AHOH723

site_idAC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE EDO A 405
ChainResidue
AASN159
AGLN189
ALEU192
AARG293
AASN308
AHOH580

site_idAC6
Number of Residues9
DetailsBINDING SITE FOR RESIDUE CIT A 406
ChainResidue
AGLY24
AARG25
AGLY26
ATYR58
ANAP401
AHOH577
AHOH619
AHOH631
AHOH677

Functional Information from PROSITE/UniProt
site_idPS00062
Number of Residues18
DetailsALDOKETO_REDUCTASE_2 Aldo/keto reductase family signature 2. MqdarqlglARSIGVSNF
ChainResidueDetails
AMET143-PHE160

site_idPS00063
Number of Residues16
DetailsALDOKETO_REDUCTASE_3 Aldo/keto reductase family putative active site signature. IPKSTNkqRIaQNiDL
ChainResidueDetails
AILE257-LEU272

site_idPS00798
Number of Residues18
DetailsALDOKETO_REDUCTASE_1 Aldo/keto reductase family signature 1. GYRHIDTAavyqdEeqVG
ChainResidueDetails
AGLY48-GLY65

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues1
DetailsACT_SITE: Proton donor => ECO:0000250
ChainResidueDetails
ATYR58

site_idSWS_FT_FI2
Number of Residues5
DetailsBINDING: BINDING => ECO:0000269|PubMed:24012638
ChainResidueDetails
AGLY22
AASP53
ASER158
AARG215
ALYS259

218853

건을2024-04-24부터공개중

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