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3KRZ

Crystal Structure of the Thermostable NADH4-bound old yellow enzyme from Thermoanaerobacter pseudethanolicus E39

Functional Information from GO Data
ChainGOidnamespacecontents
A0000166molecular_functionnucleotide binding
A0003959molecular_functionNADPH dehydrogenase activity
A0010181molecular_functionFMN binding
A0016491molecular_functionoxidoreductase activity
A0050661molecular_functionNADP binding
B0000166molecular_functionnucleotide binding
B0003959molecular_functionNADPH dehydrogenase activity
B0010181molecular_functionFMN binding
B0016491molecular_functionoxidoreductase activity
B0050661molecular_functionNADP binding
C0000166molecular_functionnucleotide binding
C0003959molecular_functionNADPH dehydrogenase activity
C0010181molecular_functionFMN binding
C0016491molecular_functionoxidoreductase activity
C0050661molecular_functionNADP binding
D0000166molecular_functionnucleotide binding
D0003959molecular_functionNADPH dehydrogenase activity
D0010181molecular_functionFMN binding
D0016491molecular_functionoxidoreductase activity
D0050661molecular_functionNADP binding
Functional Information from PDB Data
site_idAC1
Number of Residues19
DetailsBINDING SITE FOR RESIDUE FMN A 401
ChainResidue
ASER22
AVAL283
ALEU285
AGLY307
AARG308
AHOH338
AHOH341
AHOH349
AHOH378
AHOH396
ATXD402
APRO23
AMET24
ACYS25
AALA58
AGLN100
AHIS163
AHIS166
AARG216

site_idAC2
Number of Residues19
DetailsBINDING SITE FOR RESIDUE TXD A 402
ChainResidue
ATYR27
AILE67
AHIS163
AHIS166
ATYR168
ASER250
AGLY252
AILE258
ALEU260
ATYR264
AGLN265
AHOH396
AFMN401
AHOH449
AHOH882
AHOH925
AHOH966
AHOH1045
AHOH1203

site_idAC3
Number of Residues19
DetailsBINDING SITE FOR RESIDUE FMN B 401
ChainResidue
BSER22
BPRO23
BMET24
BCYS25
BALA58
BGLN100
BHIS163
BHIS166
BARG216
BVAL283
BLEU285
BGLY307
BARG308
BHOH340
BHOH351
BHOH357
BHOH369
BHOH394
BTXD402

site_idAC4
Number of Residues23
DetailsBINDING SITE FOR RESIDUE TXD B 402
ChainResidue
AARG333
BTYR27
BILE67
BHIS163
BHIS166
BTYR168
BSER250
BGLY251
BGLY252
BVAL256
BILE258
BLEU260
BTYR264
BGLN265
BHOH369
BHOH396
BFMN401
BHOH527
BHOH595
BHOH602
BHOH630
BHOH765
BHOH1607

site_idAC5
Number of Residues20
DetailsBINDING SITE FOR RESIDUE FMN C 401
ChainResidue
CTXD402
CSER22
CPRO23
CMET24
CCYS25
CALA58
CGLN100
CHIS163
CHIS166
CARG216
CVAL283
CGLY284
CLEU285
CGLY307
CARG308
CHOH338
CHOH340
CHOH347
CHOH385
CHOH387

site_idAC6
Number of Residues18
DetailsBINDING SITE FOR RESIDUE TXD C 402
ChainResidue
CTYR27
CILE67
CHIS163
CHIS166
CTYR168
CSER250
CGLY252
CILE258
CLEU260
CTYR264
CGLN265
CHOH385
CFMN401
CHOH644
CHOH760
CHOH864
CHOH1050
CHOH1723

site_idAC7
Number of Residues20
DetailsBINDING SITE FOR RESIDUE FMN D 401
ChainResidue
DSER22
DPRO23
DMET24
DCYS25
DALA58
DGLN100
DHIS163
DHIS166
DARG216
DVAL283
DGLY284
DLEU285
DGLY307
DARG308
DHOH339
DHOH345
DHOH352
DHOH373
DHOH394
DTXD402

site_idAC8
Number of Residues19
DetailsBINDING SITE FOR RESIDUE TXD D 402
ChainResidue
CARG333
DTYR27
DILE67
DHIS163
DHIS166
DTYR168
DSER250
DGLY252
DILE258
DLEU260
DTYR264
DGLN265
DHOH394
DFMN401
DHOH500
DHOH587
DHOH694
DHOH716
DHOH902

Catalytic Information from CSA
site_idCSA1
Number of Residues3
DetailsAnnotated By Reference To The Literature 1oya
ChainResidueDetails
AHIS166
ATYR168
AHIS163

site_idCSA2
Number of Residues3
DetailsAnnotated By Reference To The Literature 1oya
ChainResidueDetails
BHIS166
BTYR168
BHIS163

site_idCSA3
Number of Residues3
DetailsAnnotated By Reference To The Literature 1oya
ChainResidueDetails
CHIS166
CTYR168
CHIS163

site_idCSA4
Number of Residues3
DetailsAnnotated By Reference To The Literature 1oya
ChainResidueDetails
DHIS166
DTYR168
DHIS163

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PDB entries from 2024-07-17

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