9VLP
Co-crystal structure of PA3774 bound to a trifluoromethyl oxadiazole inhibitor
This is a non-PDB format compatible entry.
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (B, A) | Histone deacetylase-like amidohydrolase | polymer | 384 | 41496.9 | 2 | UniProt (Q9HXM1) Pfam (PF00850) | Pseudomonas aeruginosa PAO1 | HDAH,Acetylated lysine deacetylase,Histone deacetylase homolog PA3774 |
| 2 | C, G (B, A) | ~{N}-[(2~{Z})-2-methoxyimino-2-(4-methylsulfonylphenyl)ethyl]-4-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]benzamide | non-polymer | 482.4 | 2 | Chemie (A1ESN) | |||
| 3 | D, H (B, A) | ZINC ION | non-polymer | 65.4 | 2 | Chemie (ZN) PubChem (32051) | |||
| 4 | E, F, I, J (B, A) | POTASSIUM ION | non-polymer | 39.1 | 4 | Chemie (K) PubChem (813) | |||
| 5 | K, L (B, A) | water | water | 18.0 | 133 | Chemie (HOH) |
Sequence modifications
B, A: 1 - 380 (UniProt: Q9HXM1)
| PDB | External Database | Details |
|---|---|---|
| Val 381 | - | expression tag |
| Asp 382 | - | expression tag |
| Ala 383 | - | expression tag |
| Leu 384 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 82993.8 | |
| Non-Polymers* | Number of molecules | 8 |
| Total formula weight | 1252.1 | |
| All* | Total formula weight | 84245.9 |
