6W81
Structure of PEDV main protease bound to potent broad-spectrum non-covalent inhibitor X77
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) | Peptidase C30 | polymer | 302 | 32820.1 | 2 | UniProt (S0AP56) Pfam (PF05409) UniProt (by SIFTS) (A0A059VJE6) | Porcine epidemic diarrhea virus | main protease |
| 2 | C, D (A, B) | N-(4-tert-butylphenyl)-N-[(1R)-2-(cyclohexylamino)-2-oxo-1-(pyridin-3-yl)ethyl]-1H-imidazole-4-carboxamide | non-polymer | 459.6 | 2 | Chemie (X77) | |||
| 3 | E (B) | MALONIC ACID | non-polymer | 104.1 | 1 | Chemie (MLA) | |||
| 4 | F, G (A, B) | water | water | 18.0 | 534 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 65640.2 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 1023.2 | |
| All* | Total formula weight | 66663.5 |
