3RC7
Crystal Structure of the Y186F mutant of KijD10, a 3-ketoreductase from Actinomadura kijaniata in complex with TDP-benzene and NADP
Functional Information from GO Data
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 27 |
| Details | BINDING SITE FOR RESIDUE NAP A 333 |
| Chain | Residue |
| A | GLY16 |
| A | TYR63 |
| A | PRO78 |
| A | LEU79 |
| A | PRO80 |
| A | LEU83 |
| A | HIS84 |
| A | GLU101 |
| A | LYS102 |
| A | ILE169 |
| A | ARG170 |
| A | CYS17 |
| A | VAL175 |
| A | ASP182 |
| A | TLO337 |
| A | HOH415 |
| A | HOH416 |
| A | HOH436 |
| A | HOH530 |
| A | HOH531 |
| A | ALA18 |
| A | ASP19 |
| A | ILE20 |
| A | ARG23 |
| A | SER42 |
| A | ARG43 |
| A | ARG47 |
| site_id | AC2 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE CL A 334 |
| Chain | Residue |
| A | ASN256 |
| A | HIS270 |
| site_id | AC3 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NA A 335 |
| Chain | Residue |
| A | ARG323 |
| A | THR324 |
| A | ALA326 |
| A | ASP328 |
| site_id | AC4 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE PO4 A 336 |
| Chain | Residue |
| A | HIS285 |
| A | LYS290 |
| A | HOH470 |
| site_id | AC5 |
| Number of Residues | 15 |
| Details | BINDING SITE FOR RESIDUE TLO A 337 |
| Chain | Residue |
| A | ARG23 |
| A | ARG24 |
| A | PHE159 |
| A | ILE161 |
| A | PRO162 |
| A | TYR240 |
| A | ARG257 |
| A | THR260 |
| A | GLN274 |
| A | NAP333 |
| A | HOH457 |
| A | HOH477 |
| A | HOH478 |
| A | HOH505 |
| A | HOH561 |
| site_id | AC6 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE CL A 338 |
| Chain | Residue |
| A | LYS102 |
| A | MET130 |
| A | PHE131 |
| A | PHE186 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 1 |
| Details | ACT_SITE: Proton donor => ECO:0000269|PubMed:21598943, ECO:0007744|PDB:3RBV, ECO:0007744|PDB:3RC1, ECO:0007744|PDB:3RC2, ECO:0007744|PDB:3RC7, ECO:0007744|PDB:3RC9, ECO:0007744|PDB:3RCB |
| Chain | Residue | Details |
| A | LYS102 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 4 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:21598943, ECO:0007744|PDB:3RBV, ECO:0007744|PDB:3RC1, ECO:0007744|PDB:3RC2, ECO:0007744|PDB:3RC7, ECO:0007744|PDB:3RC9, ECO:0007744|PDB:3RCB |
| Chain | Residue | Details |
| A | SER42 | |
| A | TYR63 | |
| A | ASP182 | |
| A | CYS17 |
| site_id | SWS_FT_FI3 |
| Number of Residues | 3 |
| Details | BINDING: BINDING => ECO:0000305|PubMed:21598943, ECO:0007744|PDB:3RC1, ECO:0007744|PDB:3RC2, ECO:0007744|PDB:3RC7, ECO:0007744|PDB:3RC9, ECO:0007744|PDB:3RCB |
| Chain | Residue | Details |
| A | ARG24 | |
| A | TYR240 | |
| A | THR260 |
| site_id | SWS_FT_FI4 |
| Number of Residues | 2 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:21598943, ECO:0007744|PDB:3RBV, ECO:0007744|PDB:3RC1, ECO:0007744|PDB:3RC2, ECO:0007744|PDB:3RC7, ECO:0007744|PDB:3RCB |
| Chain | Residue | Details |
| A | LEU79 | |
| A | HIS84 |
| site_id | SWS_FT_FI5 |
| Number of Residues | 1 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:21598943, ECO:0007744|PDB:3RC1, ECO:0007744|PDB:3RC7 |
| Chain | Residue | Details |
| A | ARG170 |
