7JST

Crystal structure of SARS-CoV-2 3CL in apo form

Summary for 7JST

• Entry DOI: 10.2210/pdb7jst/pdb
• Descriptor: 3C-like proteinase, PHOSPHATE ION (3 entities in total)
• Functional Keywords: 3cl main protease, viral protein, hydrolase
• Biological source: Severe acute respiratory syndrome coronavirus 2 (2019-nCoV, SARS-CoV-2, COVID-19 virus)
• Total number of polymer chains: 1
• Total formula weight: 33920.52

Authors

Iketani, S.,Forouhar, F.,Liu, H.,Hong, S.J.,Lin, F.-Y.,Nair, M.S.,Zask, A.,Huang, Y.,Xing, L.,Stockwell, B.R.,Chavez, A.,Ho, D.D. (deposition date: 2020-08-16, release date: 2021-03-03, Last modification date: 2023-10-18)

• Primary citation: Iketani, S.,Forouhar, F.,Liu, H.,Hong, S.J.,Lin, F.Y.,Nair, M.S.,Zask, A.,Huang, Y.,Xing, L.,Stockwell, B.R.,Chavez, A.,Ho, D.D.; Lead compounds for the development of SARS-CoV-2 3CL protease inhibitors.; Nat Commun, 12:2016-2016, 2021; PubMed: 33795671; DOI: 10.1038/s41467-021-22362-2

Experimental method

X-RAY DIFFRACTION (1.85 Å)