9KSJ
Crystal structure of SARS-CoV-2 main protease in complex with compound 8
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 (A) | 3C-like proteinase nsp5 | polymer | 301 | 33334.0 | 1 | UniProt (P0DTD1) Pfam (PF05409) | Severe acute respiratory syndrome coronavirus 2 (2019-nCoV SARS-CoV-2) | 3CL-PRO,3CLp,Main protease,Mpro,Non-structural protein 5,nsp5,SARS coronavirus main proteinase |
| 2 | B (A) | 3-[[(6E)-6-(6-chloranyl-2-methyl-indazol-5-yl)imino-3-[5-(2-methoxyethoxy)pyridin-3-yl]-2,4-bis(oxidanylidene)-1,3,5-triazinan-1-yl]methyl]-4-methyl-benzenecarbonitrile | non-polymer | 573.0 | 1 | Chemie (A1EGR) | |||
| 3 | C (A) | water | water | 18.0 | 211 | Chemie (HOH) |
Sequence modifications
A: 1 - 301 (UniProt: P0DTD1)
| PDB | External Database | Details |
|---|---|---|
| His 132 | Pro 3395 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 33334.0 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 573.0 | |
| All* | Total formula weight | 33907.0 |
