9H12
Crystal structure of OXA-48 in complex with nacubactam
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (A, B) | Beta-lactamase | polymer | 245 | 28338.1 | 2 | UniProt (Q6XEC0) Pfam (PF00905) | Klebsiella pneumoniae | |
| 2 | C, D, X (A, B) | CHLORIDE ION | non-polymer | 35.5 | 3 | Chemie (CL) | |||
| 3 | E, G, HA, U, V (A, B) | TRIETHYLENE GLYCOL | non-polymer | 150.2 | 5 | Chemie (PGE) | |||
| 4 | CA, F, H, I, J (B, A) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 5 | Chemie (PEG) | |||
| 5 | BA, DA, GA, IA, K... (B, A) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 11 | Chemie (EDO) | |||
| 6 | EA, Q (B, A) | (2S,5R)-N-(2-aminoethoxy)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide | non-polymer | 326.3 | 2 | Chemie (OP0) | |||
| 7 | FA, R, T (B, A) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 3 | Chemie (DMS) | |||
| 8 | AA, W, Y (B, A) | GLYCEROL | non-polymer | 92.1 | 3 | Chemie (GOL) | |||
| 9 | Z (B) | TETRAETHYLENE GLYCOL | non-polymer | 194.2 | 1 | Chemie (PG4) | |||
| 10 | JA, KA (A, B) | water | water | 18.0 | 329 | Chemie (HOH) |
Sequence modifications
A, B: 23 - 265 (UniProt: Q6XEC0)
| PDB | External Database | Details |
|---|---|---|
| Gly 21 | - | expression tag |
| Pro 22 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 56676.2 | |
| Non-Polymers* | Number of molecules | 33 |
| Total formula weight | 3428.1 | |
| All* | Total formula weight | 60104.4 |
