4WKU
n-Alkylboronic Acid Inhibitors Reveal Determinants of Ligand Specificity in the Quorum-Quenching and Siderophore Biosynthetic Enzyme PvdQ
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Acyl-homoserine lactone acylase PvdQ | polymer | 165 | 17993.2 | 1 | UniProt (Q9I194) | Pseudomonas aeruginosa | Acyl-HSL acylase PvdQ |
| 2 | B (B) | Acyl-homoserine lactone acylase PvdQ | polymer | 548 | 60632.1 | 1 | UniProt (Q9I194) Pfam (PF01804) | Pseudomonas aeruginosa | Acyl-HSL acylase PvdQ |
| 3 | C, D, E, F, H... (A, B) | GLYCEROL | non-polymer | 92.1 | 16 | Chemie (GOL) | |||
| 4 | G (B) | hexyl(trihydroxy)borate(1-) | non-polymer | 147.0 | 1 | Chemie (3QJ) | |||
| 5 | T, U (A, B) | water | water | 18.0 | 548 | Chemie (HOH) |
Sequence modifications
B: 217 - 762 (UniProt: Q9I194)
| PDB | External Database | Details |
|---|---|---|
| Ala 763 | - | expression tag |
| Ala 764 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 78625.3 | |
| Non-Polymers* | Number of molecules | 17 |
| Total formula weight | 1620.5 | |
| All* | Total formula weight | 80245.8 |
