3MV6
Axial Ligand Swapping In Double Mutant Maintains Intradiol-cleavage Chemistry in Protocatechuate 3,4-Dioxygenase
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C (A, B, C) | Protocatechuate 3,4-dioxygenase alpha chain | polymer | 200 | 22278.8 | 3 | UniProt (P00436) Pfam (PF00775) | Pseudomonas putida | 3,4-PCD |
| 2 | D, E, F (M, N, O) | Protocatechuate 3,4-dioxygenase beta chain | polymer | 238 | 26696.3 | 3 | UniProt (P00437) Pfam (PF12391) Pfam (PF00775) | Pseudomonas putida | 3,4-PCD |
| 3 | G, H, J, K, N... (A, B, C, N, O) | SULFATE ION | non-polymer | 96.1 | 7 | Chemie (SO4) | |||
| 4 | I, O, P (A, C) | GLYCEROL | non-polymer | 92.1 | 3 | Chemie (GOL) | |||
| 5 | L, M, Q, U, V... (B, M, N) | BETA-MERCAPTOETHANOL | non-polymer | 78.1 | 6 | Chemie (BME) | |||
| 6 | BA, R, X (O, M, N) | FE (III) ION | non-polymer | 55.8 | 3 | Chemie (FE) | |||
| 7 | CA, S, Y (O, M, N) | 3,4-DIHYDROXYBENZOIC ACID | non-polymer | 154.1 | 3 | Chemie (DHB) | |||
| 8 | AA (O) | CHLORIDE ION | non-polymer | 35.5 | 1 | Chemie (CL) | |||
| 9 | DA, EA, FA, GA, HA... (A, B, C, M, N...) | water | water | 18.0 | 936 | Chemie (HOH) |
Sequence modifications
M, N, O: 301 - 538 (UniProt: P00437)
| PDB | External Database | Details |
|---|---|---|
| His 447 | Tyr 148 | engineered mutation |
| Tyr 462 | His 163 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 6 |
| Total formula weight | 146925.3 | |
| Non-Polymers* | Number of molecules | 23 |
| Total formula weight | 2082.9 | |
| All* | Total formula weight | 149008.2 |
