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1R37

Alcohol dehydrogenase from sulfolobus solfataricus complexed with NAD(H) and 2-ethoxyethanol

Functional Information from GO Data
ChainGOidnamespacecontents
A0004022molecular_functionalcohol dehydrogenase (NAD+) activity
A0008270molecular_functionzinc ion binding
A0016491molecular_functionoxidoreductase activity
A0046872molecular_functionmetal ion binding
B0004022molecular_functionalcohol dehydrogenase (NAD+) activity
B0008270molecular_functionzinc ion binding
B0016491molecular_functionoxidoreductase activity
B0046872molecular_functionmetal ion binding
Functional Information from PDB Data
site_idAC1
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN A 500
ChainResidue
ACYS38
AHIS68
ACYS154
ANAD403
AETX600

site_idAC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN A 400
ChainResidue
AGLU98
ACYS101
ACYS104
ACYS112

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN B 500
ChainResidue
BCYS38
BHIS68
BCYS154
BNAD403
BETX600

site_idAC4
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ZN B 400
ChainResidue
BGLU98
BCYS101
BCYS104
BCYS112

site_idAC5
Number of Residues33
DetailsBINDING SITE FOR RESIDUE NAD A 403
ChainResidue
ACYS38
AHIS39
ASER40
AHIS43
ACYS154
ATHR158
AGLY178
AGLY180
AGLY181
AGLY182
ALEU183
AASP203
AVAL204
AARG205
ALEU247
AASN248
AVAL270
AGLY271
ALEU272
APHE273
ASER294
ALEU295
AVAL296
ALEU334
AARG342
AZN500
AETX600
AHOH605
AHOH613
AHOH650
AHOH664
AHOH704
BTHR285

site_idAC6
Number of Residues8
DetailsBINDING SITE FOR RESIDUE ETX A 600
ChainResidue
ASER40
APHE49
AHIS68
ATRP95
ATRP117
ACYS154
ANAD403
AZN500

site_idAC7
Number of Residues33
DetailsBINDING SITE FOR RESIDUE NAD B 403
ChainResidue
BLEU334
BARG342
BZN500
BETX600
BHOH606
BHOH612
BHOH617
BHOH646
BHOH654
ATHR285
BCYS38
BHIS39
BSER40
BHIS43
BCYS154
BTHR158
BGLY178
BGLY180
BGLY181
BGLY182
BLEU183
BASP203
BVAL204
BARG205
BLEU247
BASN248
BVAL270
BGLY271
BLEU272
BPHE273
BSER294
BLEU295
BVAL296

site_idAC8
Number of Residues8
DetailsBINDING SITE FOR RESIDUE ETX B 600
ChainResidue
BSER40
BPHE49
BHIS68
BTRP95
BTRP117
BCYS154
BNAD403
BZN500

site_idZNC
Number of Residues4
DetailsRESIDUES THAT BIND THE CATALYTIC ZINC ION (ZN A 500)
ChainResidue
ACYS38
ACYS154
AHIS68
AETX600

site_idZND
Number of Residues4
DetailsRESIDUES THAT BIND THE CATALYTIC ZINC ION (ZN B 500)
ChainResidue
BCYS38
BCYS154
BHIS68
BETX600

site_idZNS
Number of Residues4
DetailsRESIDUES THAT BIND A STRUCTURAL ZINC ION (ZN A 400) IN THE CATALYTIC DOMAIN
ChainResidue
ACYS112
AGLU98
ACYS101
ACYS104

site_idZNT
Number of Residues4
DetailsRESIDUES THAT BIND A STRUCTURAL ZINC ION (ZN B 400) IN THE CATALYTIC DOMAIN
ChainResidue
BGLU98
BCYS101
BCYS104
BCYS112

Functional Information from PROSITE/UniProt
site_idPS00059
Number of Residues15
DetailsADH_ZINC Zinc-containing alcohol dehydrogenases signature. GHEiAGKieevGdeV
ChainResidueDetails
AGLY67-VAL81

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues14
DetailsBINDING:
ChainResidueDetails
ACYS38
BGLU98
BCYS101
BCYS104
BCYS112
BCYS154
AHIS68
AGLU98
ACYS101
ACYS104
ACYS112
ACYS154
BCYS38
BHIS68

site_idSWS_FT_FI2
Number of Residues4
DetailsMOD_RES: N6-methyllysine; partial => ECO:0000269|PubMed:1463738
ChainResidueDetails
ALYS11
ALYS213
BLYS11
BLYS213

Catalytic Information from CSA
site_idCSA1
Number of Residues2
DetailsAnnotated By Reference To The Literature 1teh
ChainResidueDetails
ASER40
AHIS39

site_idCSA2
Number of Residues2
DetailsAnnotated By Reference To The Literature 1teh
ChainResidueDetails
BSER40
BHIS39

site_idCSA3
Number of Residues1
DetailsAnnotated By Reference To The Literature 1teh
ChainResidueDetails
APHE49

site_idCSA4
Number of Residues1
DetailsAnnotated By Reference To The Literature 1teh
ChainResidueDetails
BPHE49

site_idCSA5
Number of Residues2
DetailsAnnotated By Reference To The Literature 1teh
ChainResidueDetails
ASER40
AHIS43

site_idCSA6
Number of Residues2
DetailsAnnotated By Reference To The Literature 1teh
ChainResidueDetails
BSER40
BHIS43

224572

PDB entries from 2024-09-04

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