7LB7
Joint X-ray/neutron structure of SARS-CoV-2 main protease (3CL Mpro) in complex with Telaprevir
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 | polymer | 306 | 33825.5 | 1 | UniProt (P0DTD1) Pfam (PF05409) | Severe acute respiratory syndrome coronavirus 2 (2019-nCoV SARS-CoV-2) | 3CL-PRO,3CLP,Main protease,Mpro |
| 2 | B (A) | (1S,3aR,6aS)-2-[(2S)-2-({(2S)-2-cyclohexyl-2-[(pyrazin-2-ylcarbonyl)amino]acetyl}amino)-3,3-dimethylbutanoyl]-N-[(2R,3S)-1-(cyclopropylamino)-2-hydroxy-1-oxohexan-3-yl]octahydrocyclopenta[c]pyrrole-1-carboxamide | non-polymer | 681.9 | 1 | Chemie (SV6) PubChem (23634854) PubChem (58991585) PubChem (59235545) PubChem (59235547) PubChem (59519874) PubChem (70905009) PubChem (74074001) PubChem (78358367) PubChem (78358368) PubChem (78358369) PubChem (59235546) PubChem (59235541) PubChem (59356439) PubChem (68458137) PubChem (68573663) PubChem (70315220) PubChem (70702388) PubChem (70904955) PubChem (89431687) PubChem (89827385) PubChem (101878924) PubChem (117627200) PubChem (117844340) PubChem (117844342) PubChem (117879778) PubChem (142694691) | |||
| 3 | C (A) | water | water | 18.0 | 95 | Chemie (DOD) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 33825.5 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 681.9 | |
| All* | Total formula weight | 34507.4 |
