3GB4
Crystal Structure of Dicamba Monooxygenase with Non-heme Cobalt and Dicamba
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0004497 | molecular_function | monooxygenase activity |
| A | 0009056 | biological_process | catabolic process |
| A | 0016491 | molecular_function | oxidoreductase activity |
| A | 0016705 | molecular_function | oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen |
| A | 0046872 | molecular_function | metal ion binding |
| A | 0051537 | molecular_function | 2 iron, 2 sulfur cluster binding |
| B | 0004497 | molecular_function | monooxygenase activity |
| B | 0009056 | biological_process | catabolic process |
| B | 0016491 | molecular_function | oxidoreductase activity |
| B | 0016705 | molecular_function | oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen |
| B | 0046872 | molecular_function | metal ion binding |
| B | 0051537 | molecular_function | 2 iron, 2 sulfur cluster binding |
| C | 0004497 | molecular_function | monooxygenase activity |
| C | 0009056 | biological_process | catabolic process |
| C | 0016491 | molecular_function | oxidoreductase activity |
| C | 0016705 | molecular_function | oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen |
| C | 0046872 | molecular_function | metal ion binding |
| C | 0051537 | molecular_function | 2 iron, 2 sulfur cluster binding |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE FES A 501 |
| Chain | Residue |
| A | CYS49 |
| A | HIS51 |
| A | ARG52 |
| A | CYS68 |
| A | TYR70 |
| A | HIS71 |
| A | LEU73 |
| site_id | AC2 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE CO A 502 |
| Chain | Residue |
| A | HIS165 |
| A | ASP294 |
| A | HOH700 |
| A | ASN154 |
| A | HIS160 |
| site_id | AC3 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE D3M A 601 |
| Chain | Residue |
| A | LEU202 |
| A | ASN230 |
| A | ILE232 |
| A | GLY249 |
| A | HIS251 |
| A | TRP285 |
| A | HOH700 |
| A | HOH819 |
| A | HOH825 |
| site_id | AC4 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE CO A 602 |
| Chain | Residue |
| A | HIS65 |
| A | HOH930 |
| C | ASP172 |
| C | HOH1082 |
| site_id | AC5 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE FES B 501 |
| Chain | Residue |
| B | CYS49 |
| B | HIS51 |
| B | ARG52 |
| B | CYS68 |
| B | TYR70 |
| B | HIS71 |
| B | LEU73 |
| site_id | AC6 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE CO B 502 |
| Chain | Residue |
| B | ASN154 |
| B | HIS160 |
| B | HIS165 |
| B | ASP294 |
| B | HOH701 |
| site_id | AC7 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE D3M B 601 |
| Chain | Residue |
| B | LEU158 |
| B | LEU202 |
| B | ASN218 |
| B | ASN230 |
| B | HIS251 |
| B | TRP285 |
| B | HOH751 |
| B | HOH954 |
| site_id | AC8 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE CO B 602 |
| Chain | Residue |
| B | HIS65 |
| B | HOH921 |
| site_id | AC9 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE CO B 603 |
| Chain | Residue |
| B | HIS83 |
| B | HOH941 |
| B | HOH1130 |
| site_id | BC1 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE FES C 501 |
| Chain | Residue |
| C | CYS49 |
| C | HIS51 |
| C | ARG52 |
| C | CYS68 |
| C | HIS71 |
| C | LEU73 |
| site_id | BC2 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE CO C 502 |
| Chain | Residue |
| C | ASN154 |
| C | HIS160 |
| C | HIS165 |
| C | ASP294 |
| C | HOH703 |
| site_id | BC3 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE CO C 602 |
| Chain | Residue |
| C | HIS65 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 21 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:19616009, ECO:0000269|PubMed:19616011, ECO:0007744|PDB:3GB4, ECO:0007744|PDB:3GKE, ECO:0007744|PDB:3GL0, ECO:0007744|PDB:3GL2, ECO:0007744|PDB:3GOB, ECO:0007744|PDB:3GTE, ECO:0007744|PDB:3GTS |
| Chain | Residue | Details |
| A | CYS49 | |
| B | CYS68 | |
| B | HIS71 | |
| B | HIS160 | |
| B | HIS165 | |
| B | ASP294 | |
| C | CYS49 | |
| C | HIS51 | |
| C | CYS68 | |
| C | HIS71 | |
| C | HIS160 | |
| A | HIS51 | |
| C | HIS165 | |
| C | ASP294 | |
| A | CYS68 | |
| A | HIS71 | |
| A | HIS160 | |
| A | HIS165 | |
| A | ASP294 | |
| B | CYS49 | |
| B | HIS51 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 6 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:19616009, ECO:0000269|PubMed:19616011, ECO:0007744|PDB:3GB4, ECO:0007744|PDB:3GKE, ECO:0007744|PDB:3GL0, ECO:0007744|PDB:3GL2, ECO:0007744|PDB:3GOB, ECO:0007744|PDB:3GTS |
| Chain | Residue | Details |
| A | ASN230 | |
| A | HIS251 | |
| B | ASN230 | |
| B | HIS251 | |
| C | ASN230 | |
| C | HIS251 |
| site_id | SWS_FT_FI3 |
| Number of Residues | 3 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:19616009, ECO:0000269|PubMed:19616011, ECO:0007744|PDB:3GB4, ECO:0007744|PDB:3GKE, ECO:0007744|PDB:3GL0, ECO:0007744|PDB:3GL2, ECO:0007744|PDB:3GTS |
| Chain | Residue | Details |
| A | TRP285 | |
| B | TRP285 | |
| C | TRP285 |
| site_id | SWS_FT_FI4 |
| Number of Residues | 3 |
| Details | SITE: Plays a role in the stabilization of the metal coordination => ECO:0000269|PubMed:19616009 |
| Chain | Residue | Details |
| A | ASN154 | |
| B | ASN154 | |
| C | ASN154 |
Catalytic Information from CSA
| site_id | CSA1 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1ndo |
| Chain | Residue | Details |
| A | ASP157 | |
| A | HIS160 |
| site_id | CSA2 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1ndo |
| Chain | Residue | Details |
| B | ASP157 | |
| B | HIS160 |
| site_id | CSA3 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1ndo |
| Chain | Residue | Details |
| C | ASP157 | |
| C | HIS160 |
| site_id | CSA4 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1ndo |
| Chain | Residue | Details |
| A | HIS71 |
| site_id | CSA5 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1ndo |
| Chain | Residue | Details |
| B | HIS71 |
| site_id | CSA6 |
| Number of Residues | 1 |
| Details | Annotated By Reference To The Literature 1ndo |
| Chain | Residue | Details |
| C | HIS71 |
