9Z6C
Crystal structure of SARS-CoV-2 PLpro in complex with compound 14
This is a non-PDB format compatible entry.
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) | Papain-like protease nsp3 | polymer | 319 | 36039.9 | 2 | UniProt (P0DTD1) Pfam (PF08715) | Severe acute respiratory syndrome coronavirus 2 (2019-nCoV SARS-CoV-2) | Non-structural protein 3,nsp3,PL2-PRO,Papain-like proteinase,PL-PRO |
| 2 | C, F (A, B) | methyl 4-{[(2E)-2-{[(2S)-3-amino-2-(1-{(1R)-1-[7-(propan-2-yl)naphthalen-1-yl]ethyl}piperidin-4-yl)propanoyl]imino}acetyl]amino}butanoate | non-polymer | 522.7 | 2 | Chemie (A1C1A) | |||
| 3 | D, G (A, B) | CHLORIDE ION | non-polymer | 35.5 | 2 | Chemie (CL) | |||
| 4 | E, H (A, B) | ZINC ION | non-polymer | 65.4 | 2 | Chemie (ZN) | |||
| 5 | I, J (A, B) | water | water | 18.0 | 204 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 318 (UniProt: P0DTD1)
| PDB | External Database | Details |
|---|---|---|
| Ala 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 72079.9 | |
| Non-Polymers* | Number of molecules | 6 |
| Total formula weight | 1247.1 | |
| All* | Total formula weight | 73326.9 |
