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3GEG

Fingerprint and Structural Analysis of a SCOR enzyme with its bound cofactor from Clostridium thermocellum

Replaces:  3DIJ
Functional Information from GO Data
ChainGOidnamespacecontents
A0000166molecular_functionnucleotide binding
A0006633biological_processfatty acid biosynthetic process
A0008206biological_processbile acid metabolic process
A0016491molecular_functionoxidoreductase activity
A0016616molecular_functionoxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
A0048038molecular_functionquinone binding
B0000166molecular_functionnucleotide binding
B0006633biological_processfatty acid biosynthetic process
B0008206biological_processbile acid metabolic process
B0016491molecular_functionoxidoreductase activity
B0016616molecular_functionoxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
B0048038molecular_functionquinone binding
Functional Information from PDB Data
site_idAC1
Number of Residues27
DetailsBINDING SITE FOR RESIDUE NAD A 248
ChainResidue
AGLY9
AASN82
ACYS84
AARG85
ATYR101
AVAL105
AILE131
AALA132
ASER133
ATYR146
ALYS150
AHIS12
APRO175
AGLY176
AILE178
AVAL180
AHOH287
AHOH291
AHOH362
AHOH381
AILE14
AASP33
AILE34
AARG38
AGLY54
AASP55
AVAL56

site_idAC2
Number of Residues2
DetailsBINDING SITE FOR RESIDUE GOL A 249
ChainResidue
AARG135
AHOH362

site_idAC3
Number of Residues9
DetailsBINDING SITE FOR RESIDUE THJ A 250
ChainResidue
ALYS16
AASP41
AARG46
AHOH347
BLYS16
BASP41
BARG46
BHOH254
BHOH370

site_idAC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE NA A 251
ChainResidue
AALA43
AARG46
ALEU49
AHOH358
AHOH382

site_idAC5
Number of Residues25
DetailsBINDING SITE FOR RESIDUE NAD B 248
ChainResidue
BGLY9
BHIS12
BILE14
BASP33
BILE34
BGLY54
BASP55
BVAL56
BASN82
BCYS84
BARG85
BTYR101
BVAL105
BILE131
BALA132
BSER133
BTYR146
BLYS150
BPRO175
BGLY176
BILE178
BVAL180
BHOH275
BHOH276
BHOH313

site_idAC6
Number of Residues2
DetailsBINDING SITE FOR RESIDUE GOL B 249
ChainResidue
BARG135
BHOH313

site_idAC7
Number of Residues6
DetailsBINDING SITE FOR RESIDUE NA B 250
ChainResidue
BALA43
BARG46
BLEU49
BHOH362
BHOH372
BHOH384

Functional Information from PROSITE/UniProt
site_idPS00061
Number of Residues29
DetailsADH_SHORT Short-chain dehydrogenases/reductases family signature. StrafqsepdSeaYASAKGGIvALThALA
ChainResidueDetails
ASER133-ALA161

Catalytic Information from CSA
site_idCSA1
Number of Residues3
DetailsAnnotated By Reference To The Literature 1eq2
ChainResidueDetails
ASER133
ALYS150
ATYR146

site_idCSA2
Number of Residues3
DetailsAnnotated By Reference To The Literature 1eq2
ChainResidueDetails
BSER133
BLYS150
BTYR146

site_idCSA3
Number of Residues2
DetailsAnnotated By Reference To The Literature 1eq2
ChainResidueDetails
ASER143
ALYS150

site_idCSA4
Number of Residues2
DetailsAnnotated By Reference To The Literature 1eq2
ChainResidueDetails
BSER143
BLYS150

site_idCSA5
Number of Residues2
DetailsAnnotated By Reference To The Literature 1eq2
ChainResidueDetails
ATYR146
ALYS150

site_idCSA6
Number of Residues2
DetailsAnnotated By Reference To The Literature 1eq2
ChainResidueDetails
BTYR146
BLYS150

247947

PDB entries from 2026-01-21

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