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TitleX-ray crystal structure of SARS-CoV-2 main protease quadruple mutants in complex with Ensitrelvir
Journal, issue, pagesTo Be Published
Publish dateJul 7, 2024 (structure data deposition date)
AuthorsEsler, M.A. / Shi, K. / Harris, R.S. / Aihara, H.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution2.24 Å
Structure data

PDB-9cjq:
X-ray crystal structure of SARS-CoV-2 main protease quadruple mutants in complex with Ensitrelvir
Method: X-RAY DIFFRACTION / Resolution: 2.24 Å

Chemicals

ChemComp-7YY:
6-[(6-chloranyl-2-methyl-indazol-5-yl)amino]-3-[(1-methyl-1,2,4-triazol-3-yl)methyl]-1-[[2,4,5-tris(fluoranyl)phenyl]methyl]-1,3,5-triazine-2,4-dione / medication, antivirus, protease inhibitor*YM

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-HOH:
WATER

Source
  • severe acute respiratory syndrome coronavirus 2
KeywordsHYDROLASE/INHIBITOR / HYDROLASE-INHIBITOR complex / SARS2

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