3ZV6
CRYSTAL STRUCTURE OF CIS-BIPHENYL-2,3-DIHYDRODIOL-2,3-DEHYDROGENASE (BPHB) FROM PANDORAEA PNOMENUSA STRAIN B-356 COMPLEX WITH CO-ENZYME NAD AND PRODUCT ANALOG 4,4'-DIHYDROXYBIPHENYL
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0004090 | molecular_function | carbonyl reductase (NADPH) activity |
| A | 0016491 | molecular_function | oxidoreductase activity |
| A | 0016628 | molecular_function | oxidoreductase activity, acting on the CH-CH group of donors, NAD or NADP as acceptor |
| A | 0018509 | molecular_function | cis-2,3-dihydrobiphenyl-2,3-diol dehydrogenase activity |
| A | 0019439 | biological_process | obsolete aromatic compound catabolic process |
| B | 0004090 | molecular_function | carbonyl reductase (NADPH) activity |
| B | 0016491 | molecular_function | oxidoreductase activity |
| B | 0016628 | molecular_function | oxidoreductase activity, acting on the CH-CH group of donors, NAD or NADP as acceptor |
| B | 0018509 | molecular_function | cis-2,3-dihydrobiphenyl-2,3-diol dehydrogenase activity |
| B | 0019439 | biological_process | obsolete aromatic compound catabolic process |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 28 |
| Details | BINDING SITE FOR RESIDUE NAD A 1276 |
| Chain | Residue |
| A | GLY12 |
| A | ASN86 |
| A | GLY88 |
| A | TYR119 |
| A | THR140 |
| A | ILE141 |
| A | SER142 |
| A | TYR155 |
| A | LYS159 |
| A | PRO184 |
| A | MET187 |
| A | SER15 |
| A | THR189 |
| A | ASP190 |
| A | LEU191 |
| A | ILE204 |
| A | LEU209 |
| A | 4HB1277 |
| A | HOH2010 |
| A | HOH2021 |
| A | HOH2023 |
| A | GLY16 |
| A | LEU17 |
| A | ASP36 |
| A | LYS37 |
| A | GLY58 |
| A | ASP59 |
| A | VAL60 |
| site_id | AC2 |
| Number of Residues | 26 |
| Details | BINDING SITE FOR RESIDUE NAD B 1276 |
| Chain | Residue |
| B | GLY12 |
| B | SER15 |
| B | GLY16 |
| B | LEU17 |
| B | GLY18 |
| B | ASP36 |
| B | LYS37 |
| B | GLY58 |
| B | ASP59 |
| B | VAL60 |
| B | ASN86 |
| B | ALA87 |
| B | GLY88 |
| B | TYR119 |
| B | THR140 |
| B | ILE141 |
| B | SER142 |
| B | TYR155 |
| B | LYS159 |
| B | PRO184 |
| B | MET187 |
| B | THR189 |
| B | ASP190 |
| B | LEU191 |
| B | ARG192 |
| B | HOH2066 |
| site_id | AC3 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE 4HB A 1277 |
| Chain | Residue |
| A | TRP90 |
| A | SER142 |
| A | ASN143 |
| A | GLY150 |
| A | TYR155 |
| A | LEU209 |
| A | LEU213 |
| A | PHE260 |
| A | NAD1276 |
Functional Information from PROSITE/UniProt
| site_id | PS00061 |
| Number of Residues | 29 |
| Details | ADH_SHORT Short-chain dehydrogenases/reductases family signature. SnagfypnggGplYTATKHAVvGLVrQMA |
| Chain | Residue | Details |
| A | SER142-ALA170 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 2 |
| Details | ACT_SITE: Proton acceptor => ECO:0000255|PROSITE-ProRule:PRU10001 |
| Chain | Residue | Details |
| A | TYR155 | |
| B | TYR155 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 4 |
| Details | BINDING: BINDING => ECO:0000250 |
| Chain | Residue | Details |
| A | ILE10 | |
| A | SER142 | |
| B | ILE10 | |
| B | SER142 |
