7P85
Engineered phosphotriesterase BdPTE 10-2-C3(C59V/C227V) in complex with ethyl-4-methylbenzylphosphonate
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Parathion hydrolase | polymer | 348 | 37684.4 | 1 | UniProt (P0A434) Pfam (PF02126) | Brevundimonas diminuta (Pseudomonas diminuta) | Phosphotriesterase,PTE |
| 2 | B (A) | ethyl-4-methylbenzylphosphonate | non-polymer | 214.2 | 1 | Chemie (5ZG) | |||
| 3 | C (A) | FORMIC ACID | non-polymer | 46.0 | 1 | Chemie (FMT) | |||
| 4 | D, E (A) | ZINC ION | non-polymer | 65.4 | 2 | Chemie (ZN) | |||
| 5 | F, G, H (A) | SULFATE ION | non-polymer | 96.1 | 3 | Chemie (SO4) | |||
| 6 | I, J, K (A) | GLYCEROL | non-polymer | 92.1 | 3 | Chemie (GOL) | |||
| 7 | L (A) | water | water | 18.0 | 251 | Chemie (HOH) |
Sequence modifications
A: 30 - 364 (UniProt: P0A434)
| PDB | External Database | Details |
|---|---|---|
| Ala 17 | - | expression tag |
| Ser 18 | - | expression tag |
| Arg 19 | - | expression tag |
| Gly 20 | - | expression tag |
| Ser 21 | - | expression tag |
| His 22 | - | expression tag |
| His 23 | - | expression tag |
| His 24 | - | expression tag |
| His 25 | - | expression tag |
| His 26 | - | expression tag |
| His 27 | - | expression tag |
| Gly 28 | - | expression tag |
| Ala 29 | - | expression tag |
| Val 59 | Cys 59 | engineered mutation |
| Ala 77 | Lys 77 | engineered mutation |
| Met 80 | Ala 80 | engineered mutation |
| Glu 118 | Arg 118 | engineered mutation |
| Glu 132 | Phe 132 | engineered mutation |
| Asn 173 | Thr 173 | engineered mutation |
| Arg 185 | Lys 185 | engineered mutation |
| Asp 203 | Ala 203 | engineered mutation |
| Asp 222 | Ser 222 | engineered mutation |
| Val 227 | Cys 227 | engineered mutation |
| Gly 233 | Asp 233 | engineered mutation |
| Asp 238 | Ser 238 | engineered mutation |
| Gly 254 | His 254 | engineered mutation |
| Ser 270 | Ala 270 | engineered mutation |
| Trp 271 | Leu 271 | engineered mutation |
| Asn 274 | Ile 274 | engineered mutation |
| Val 293 | Met 293 | engineered mutation |
| Trp 309 | Tyr 309 | engineered mutation |
| Ser 319 | Arg 319 | engineered mutation |
| Ser 342 | Pro 342 | engineered mutation |
| Thr 348 | Gly 348 | engineered mutation |
| Glu 352 | Thr 352 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 37684.4 | |
| Non-Polymers* | Number of molecules | 10 |
| Total formula weight | 955.5 | |
| All* | Total formula weight | 38640.0 |
