7UOX
NDM1-inhibitor co-structure
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) | Metallo beta-lactamase | polymer | 248 | 26294.6 | 2 | UniProt (E9NWK5) Pfam (PF00753) | Klebsiella pneumoniae | Metallo-beta-lactamase NDM-1,Metallo-beta-lactamase,NDM-1,Metallobetalactamase NDM-1,NDM1 metallo-beta-lactamase,New Delhi Metallo carbapenemase-1,New Delhi metallo beta lactamase 1,New Delhi metallo-beta-lactamase NDM-1,Subclass B1 metallo-beta-lactamase NDM-1 |
| 2 | C, I (A, B) | ACETATE ION | non-polymer | 59.0 | 2 | Chemie (ACT) | |||
| 3 | D (A) | CALCIUM ION | non-polymer | 40.1 | 1 | Chemie (CA) | |||
| 4 | E, F, J, K (A, B) | ZINC ION | non-polymer | 65.4 | 4 | Chemie (ZN) | |||
| 5 | G, L, M (A, B) | CADMIUM ION | non-polymer | 112.4 | 3 | Chemie (CD) | |||
| 6 | H, N (A, B) | (2M)-4'-(hydroxymethyl)-2-(1H-tetrazol-5-yl)[1,1'-biphenyl]-3-ol | non-polymer | 268.3 | 2 | Chemie (O0L) | |||
| 7 | O, P (A, B) | water | water | 18.0 | 670 | Chemie (HOH) |
Sequence modifications
A, B: 29 - 270 (UniProt: E9NWK5)
| PDB | External Database | Details |
|---|---|---|
| Gly 23 | - | expression tag |
| Ser 24 | - | expression tag |
| Lys 25 | - | expression tag |
| Leu 26 | - | expression tag |
| Glu 27 | - | expression tag |
| Phe 28 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 52589.2 | |
| Non-Polymers* | Number of molecules | 12 |
| Total formula weight | 1293.6 | |
| All* | Total formula weight | 53882.7 |
