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4URF

Molecular Genetic and Crystal Structural Analysis of 1-(4- Hydroxyphenyl)-Ethanol Dehydrogenase from Aromatoleum aromaticum EbN1

Functional Information from GO Data
ChainGOidnamespacecontents
A0000166molecular_functionnucleotide binding
A0016491molecular_functionoxidoreductase activity
A0016616molecular_functionoxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
A0046872molecular_functionmetal ion binding
B0000166molecular_functionnucleotide binding
B0016491molecular_functionoxidoreductase activity
B0016616molecular_functionoxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
B0046872molecular_functionmetal ion binding
Functional Information from PDB Data
site_idAC1
Number of Residues36
DetailsBINDING SITE FOR RESIDUE NAD A 1249
ChainResidue
AGLY12
AASP62
ATHR63
AASN89
AALA90
AGLY91
AILE113
AILE140
ASER141
ATYR155
ALYS159
AGLY14
APRO185
AALA186
AILE188
ATHR190
AACT1250
AHOH2020
AHOH2026
AHOH2092
AHOH2133
AHOH2155
AASN15
AHOH2181
AHOH2201
AHOH2266
AHOH2267
AHOH2268
AHOH2269
AHOH2270
AGLY16
AILE17
AASP36
AILE37
ATRP41
AALA61

site_idAC2
Number of Residues35
DetailsBINDING SITE FOR RESIDUE NAD B 1249
ChainResidue
BGLY12
BGLY14
BASN15
BGLY16
BILE17
BASP36
BILE37
BTRP41
BALA61
BASP62
BTHR63
BASN89
BALA90
BGLY91
BILE113
BILE140
BSER141
BTYR155
BLYS159
BPRO185
BALA186
BPHE187
BILE188
BTHR190
BACT1250
BHOH2018
BHOH2022
BHOH2086
BHOH2113
BHOH2133
BHOH2172
BHOH2206
BHOH2207
BHOH2208
BHOH2209

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT A 1250
ChainResidue
ASER142
ATYR155
ANAD1249
AHOH2182
AHOH2266

site_idAC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT B 1250
ChainResidue
BSER142
BTYR155
BNAD1249
BHOH2206
BHOH2210

site_idAC5
Number of Residues9
DetailsBINDING SITE FOR RESIDUE 1PS B 1251
ChainResidue
AGLY174
ASER175
AGLY177
ALEU198
AARG202
AHOH2240
BLEU210
BARG211
BARG212

site_idAC6
Number of Residues6
DetailsBINDING SITE FOR RESIDUE 1PS A 1251
ChainResidue
AILE92
ASER93
AGLY94
AARG109
AHOH2271
AHOH2272

site_idAC7
Number of Residues10
DetailsBINDING SITE FOR RESIDUE 1PS A 1252
ChainResidue
AGLN106
AHOH2139
AHOH2149
BTHR103
BASP104
BALA105
BHOH2124
AGLU95
AGLU101
ATHR103

site_idAC8
Number of Residues6
DetailsBINDING SITE FOR RESIDUE BCT B 1252
ChainResidue
BILE92
BGLY94
BARG109
BHOH2212
BHOH2213
BHOH2214

site_idAC9
Number of Residues5
DetailsBINDING SITE FOR RESIDUE BCT B 1253
ChainResidue
BARG179
BSER228
BASP229
BHOH2008
BHOH2146

site_idBC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG A 1257
ChainResidue
AHOH2060
AHOH2061
AHOH2062
AHOH2069
AHOH2275
AHOH2276

site_idBC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT A 1253
ChainResidue
AARG179
ASER228
AASP229
AHOH2012
AHOH2168

site_idBC3
Number of Residues8
DetailsBINDING SITE FOR RESIDUE MG B 1254
ChainResidue
BARG248
BARG248
BHOH2200
BHOH2200
BHOH2201
BHOH2201
BHOH2205
BHOH2205

site_idBC4
Number of Residues8
DetailsBINDING SITE FOR RESIDUE MG A 1254
ChainResidue
AARG248
AARG248
AHOH2259
AHOH2259
AHOH2261
AHOH2261
AHOH2265
AHOH2265

site_idBC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG A 1255
ChainResidue
AGLU131
AHOH2112
AHOH2164
AHOH2165
AHOH2166
AHOH2273

site_idBC6
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG A 1256
ChainResidue
ASER237
ATYR238
AHOH2245
AHOH2246
AHOH2248
AHOH2274

Functional Information from PROSITE/UniProt
site_idPS00061
Number of Residues29
DetailsADH_SHORT Short-chain dehydrogenases/reductases family signature. SiagqigiegItpYTAAKHGVvGLTkTVA
ChainResidueDetails
ASER142-ALA170

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PDB entries from 2026-02-18

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