3HKP
Crystal structure determination of Catechol 1,2-Dioxygenase from Rhodococcus opacus 1CP in complex with protocatechuate
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A | Catechol 1,2-dioxygenase | polymer | 280 | 30727.0 | 1 | UniProt (P95607) Pfam (PF04444) Pfam (PF00775) In PDB | Rhodococcus opacus (Nocardia opaca) | 1,2-CTD |
| 2 | A | FE (III) ION | non-polymer | 55.8 | 1 | Chemie (FE) | |||
| 3 | A | 3,4-DIHYDROXYBENZOIC ACID | non-polymer | 154.1 | 1 | Chemie (DHB) | |||
| 4 | A | (4S,7R)-4-HYDROXY-N,N,N-TRIMETHYL-9-OXO-7-[(PALMITOYLOXY)METHYL]-3,5,8-TRIOXA-4-PHOSPHAHEXACOSAN-1-AMINIUM 4-OXIDE | non-polymer | 763.1 | 1 | Chemie (6PL) | |||
| 5 | water | water | 18.0 | 217 | Chemie (HOH) |
Sequence modifications
A: 11 - 280 (UniProt: P95607)
| PDB | External Database | Details |
|---|---|---|
| Met 1 | - | SEE REMARK 999 |
| Thr 2 | - | SEE REMARK 999 |
| Thr 3 | - | SEE REMARK 999 |
| Thr 4 | - | SEE REMARK 999 |
| Glu 5 | - | SEE REMARK 999 |
| Ser 6 | - | SEE REMARK 999 |
| Pro 7 | - | SEE REMARK 999 |
| Thr 8 | - | SEE REMARK 999 |
| Ala 9 | - | SEE REMARK 999 |
| Ala 10 | - | SEE REMARK 999 |
| Asp 120 | Leu 110 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 30727.0 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 973.1 | |
| All* | Total formula weight | 31700.1 |
