8B1W
NDM-1 metallo-beta-lactamase in complex with triazole-based inhibitor CP35
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 NDM-1 | polymer | 242 | 25631.8 | 2 | UniProt (F6IAY7) Pfam (PF00753) | Pseudomonas aeruginosa | Metallo-beta-lactamase,Metallo-beta-lactamase NDM-1,New Delhi metallo-beta-lactamase 1,Subclass B1 metallo-beta-lactamase NDM-1 |
| 2 | C, D, I, J (A, B) | ZINC ION | non-polymer | 65.4 | 4 | Chemie (ZN) | |||
| 3 | E, F, K, L (A, B) | CALCIUM ION | non-polymer | 40.1 | 4 | Chemie (CA) | |||
| 4 | G, M (A, B) | 4-[(~{E})-(3-bromophenyl)methylideneamino]-5-(trifluoromethyl)-1,2,4-triazole-3-thiol | non-polymer | 351.1 | 2 | Chemie (OQU) | |||
| 5 | H, O, P (A, B) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 3 | Chemie (EDO) | |||
| 6 | N (B) | 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID | non-polymer | 238.3 | 1 | Chemie (EPE) | |||
| 7 | Q, R (A, B) | water | water | 18.0 | 153 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 51263.6 | |
| Non-Polymers* | Number of molecules | 14 |
| Total formula weight | 1548.7 | |
| All* | Total formula weight | 52812.4 |
