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3EF6

Crystal structure of Toluene 2,3-Dioxygenase Reductase

Functional Information from GO Data
ChainGOidnamespacecontents
A0005737cellular_componentcytoplasm
A0008860molecular_functionferredoxin-NAD+ reductase activity
A0009056biological_processcatabolic process
A0016491molecular_functionoxidoreductase activity
A0016651molecular_functionoxidoreductase activity, acting on NAD(P)H
A0042203biological_processtoluene catabolic process
Functional Information from PDB Data
site_idAC1
Number of Residues34
DetailsBINDING SITE FOR RESIDUE FAD A 449
ChainResidue
AGLY9
ASER47
ALYS48
AGLU79
AVAL80
AALA106
ATHR107
AGLY108
AARG128
AILE154
ALEU245
AGLY11
AGLY274
AASP275
AGLU290
ATHR291
ATYR292
ASER319
ATRP320
AGOL4124
AHOH4129
AHOH4131
AVAL12
AHOH4134
AHOH4139
AHOH4149
AHOH4152
AHOH4263
AGLY13
AGLY34
AASP35
AGLU36
AARG43
APRO44

site_idAC2
Number of Residues8
DetailsBINDING SITE FOR RESIDUE SO4 A4120
ChainResidue
ALEU153
AILE154
ACYS236
AGLY238
AGOL4124
AGOL4125
AHOH4173
AHOH4276

site_idAC3
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A4121
ChainResidue
AALA369
APRO370
AARG371
AASP372
AHOH4350
AHOH4470

site_idAC4
Number of Residues4
DetailsBINDING SITE FOR RESIDUE GOL A4122
ChainResidue
APRO117
AGLY118
AGLN120
ALEU121

site_idAC5
Number of Residues8
DetailsBINDING SITE FOR RESIDUE GOL A4123
ChainResidue
ALEU153
AARG287
ALEU289
APRO317
AHOH4140
AHOH4218
AHOH4239
AHOH4392

site_idAC6
Number of Residues8
DetailsBINDING SITE FOR RESIDUE GOL A4124
ChainResidue
AARG128
AASP275
AGLU290
AFAD449
ASO44120
AHOH4157
AHOH4174
AHOH4276

site_idAC7
Number of Residues8
DetailsBINDING SITE FOR RESIDUE GOL A4125
ChainResidue
AALA111
ALEU127
AILE235
ACYS236
AVAL237
AGLY238
ASO44120
AHOH4174

site_idAC8
Number of Residues10
DetailsBINDING SITE FOR RESIDUE GOL A4126
ChainResidue
AASP42
APRO44
ASER45
ALYS48
ATRP320
AGLU322
AARG327
AHOH4165
AHOH4403
AHOH4588

site_idAC9
Number of Residues4
DetailsBINDING SITE FOR RESIDUE GOL A4127
ChainResidue
APRO37
AHIS38
AHOH4208
AHOH4441

site_idBC1
Number of Residues3
DetailsBINDING SITE FOR RESIDUE GOL A4128
ChainResidue
ATYR292
AGLN296
AHOH4290

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsBINDING: BINDING => ECO:0000255
ChainResidueDetails
AHIS4
AARG145

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PDB entries from 2024-11-06

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