4OVZ
X-Ray Structural and Biological Evaluation of a Series of Potent and Highly Selective Inhibitors of Human Coronavirus Papain-Like Proteases
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A | Papain-like proteinase | polymer | 316 | 35584.3 | 1 | UniProt (P0C6U8) Pfam (PF08715) In PDB | SARS coronavirus | non-structural protein 3, nsp3, PL2-PRO, PL-PRO, SARS coronavirus main proteinase |
| 2 | B | Papain-like proteinase | polymer | 316 | 35568.3 | 1 | UniProt (P0C6U8) Pfam (PF08715) In PDB | SARS coronavirus | non-structural protein 3, nsp3, PL2-PRO, PL-PRO, SARS coronavirus main proteinase |
| 3 | A, B | ZINC ION | non-polymer | 65.4 | 2 | Chemie (ZN) | |||
| 4 | A, B | N-[(4-fluorophenyl)methyl]-1-[(1R)-1-naphthalen-1-ylethyl]piperidine-4-carboxamide | non-polymer | 390.5 | 2 | Chemie (P85) | |||
| 5 | A, B | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 5 | Chemie (DMS) | |||
| 6 | B | SODIUM ION | non-polymer | 23.0 | 1 | Chemie (NA) | |||
| 7 | water | water | 18.0 | 75 | Chemie (HOH) |
Sequence modifications
A: 2 - 316 (UniProt: P0C6U8)
B: 2 - 316 (UniProt: P0C6U8)
| PDB | External Database | Details |
|---|---|---|
| Met 1 | - | initiating methionine |
| PDB | External Database | Details |
|---|---|---|
| Met 1 | - | initiating methionine |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 71152.5 | |
| Non-Polymers* | Number of molecules | 10 |
| Total formula weight | 1325.5 | |
| All* | Total formula weight | 72478.0 |
