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4J36

Cocrystal Structure of kynurenine 3-monooxygenase in complex with UPF 648 inhibitor(KMO-394UPF)

Functional Information from GO Data
ChainGOidnamespacecontents
A0071949molecular_functionFAD binding
B0071949molecular_functionFAD binding
Functional Information from PDB Data
site_idAC1
Number of Residues33
DetailsBINDING SITE FOR RESIDUE FAD A 401
ChainResidue
AILE8
AALA53
AARG109
AHIS131
ALYS132
ALEU133
ACYS167
AASP168
AGLY169
AALA173
AGLY313
AGLY9
AASP314
AGLN325
AGLY326
AMET327
AASN328
AHOH501
AHOH508
AHOH531
AHOH548
AHOH626
AGLY11
AHOH672
AHOH710
AHOH716
AHOH717
ALEU12
AVAL13
AASP32
APHE33
AARG34
ALEU52

site_idAC2
Number of Residues34
DetailsBINDING SITE FOR RESIDUE FAD B 401
ChainResidue
BGLY9
BGLY11
BLEU12
BVAL13
BASP32
BPHE33
BARG34
BASN46
BLEU52
BALA53
BARG109
BHIS131
BLYS132
BLEU133
BCYS167
BASP168
BGLY169
BALA173
BTYR195
BGLY313
BASP314
BGLY324
BGLN325
BGLY326
BMET327
BASN328
B1HR402
BHOH501
BHOH506
BHOH578
BHOH600
BHOH604
BHOH629
BHOH640

site_idAC3
Number of Residues11
DetailsBINDING SITE FOR RESIDUE 1HR B 402
ChainResidue
BALA53
BARG83
BTYR97
BILE104
BLEU221
BILE232
BPHE246
BPRO321
BPHE322
BTYR323
BFAD401

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues14
DetailsBINDING: BINDING => ECO:0007744|PDB:4J2W, ECO:0007744|PDB:4J31, ECO:0007744|PDB:4J33, ECO:0007744|PDB:4J34, ECO:0007744|PDB:4J36
ChainResidueDetails
AVAL13
BALA53
BARG109
BLEU133
BASP314
BGLN325
AASP32
AALA53
AARG109
ALEU133
AASP314
AGLN325
BVAL13
BASP32

site_idSWS_FT_FI2
Number of Residues6
DetailsBINDING: BINDING => ECO:0000250|UniProtKB:Q84HF5
ChainResidueDetails
AARG83
ATYR97
AASN373
BARG83
BTYR97
BASN373

site_idSWS_FT_FI3
Number of Residues2
DetailsBINDING: BINDING => ECO:0007744|PDB:4J33
ChainResidueDetails
ATYR195
BTYR195

237992

PDB entries from 2025-06-25

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