8JCM
The crystal structure of SARS-CoV-2 main protease in complex with Compound 55
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | 3C-like proteinase nsp5 | polymer | 306 | 33825.5 | 1 | UniProt (P0DTC1) Pfam (PF05409) UniProt (by SIFTS) (P0DTD1) In PDB | Severe acute respiratory syndrome coronavirus 2 | 3CL-PRO,3CLp,Main protease,Mpro,Non-structural protein 5,nsp5,SARS coronavirus main proteinase |
2 | A | methyl (2S)-2-[(3-ethanoylphenyl)carbonylamino]-3-phenyl-propanoate | non-polymer | 325.4 | 1 | Chemie (AJF) | |||
3 | A | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 3 | Chemie (DMS) | |||
4 | A | HYDROSULFURIC ACID | non-polymer | 34.1 | 1 | Chemie (H2S) | |||
5 | water | water | 18.0 | 376 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 33825.5 | |
Non-Polymers* | Number of molecules | 5 |
Total formula weight | 593.8 | |
All* | Total formula weight | 34419.4 |