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TitleCrystal structure of SARS-CoV-2 main protease in complex with protease inhibitor PF-07321332.
Journal, issue, pagesProtein Cell, Vol. 13, Page 689-693, Year 2022
Publish dateSep 21, 2021 (structure data deposition date)
AuthorsZhao, Y. / Fang, C. / Zhang, Q. / Zhang, R. / Zhao, X. / Duan, Y. / Wang, H. / Zhu, Y. / Feng, L. / Zhao, J. ...Zhao, Y. / Fang, C. / Zhang, Q. / Zhang, R. / Zhao, X. / Duan, Y. / Wang, H. / Zhu, Y. / Feng, L. / Zhao, J. / Shao, M. / Yang, X. / Zhang, L. / Peng, C. / Yang, K. / Ma, D. / Rao, Z. / Yang, H.
External linksProtein Cell / PubMed:34687004
MethodsX-ray diffraction
Resolution1.59 Å
Structure data

PDB-7vh8:
Crystal structure of SARS-CoV-2 main protease in complex with protease inhibitor PF-07321332
Method: X-RAY DIFFRACTION / Resolution: 1.59 Å

Chemicals

ChemComp-4WI:
(1R,2S,5S)-N-{(1E,2S)-1-imino-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-6,6-dimethyl-3-[3-methyl-N-(trifluoroacetyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide / medication, antivirus, protease inhibitor*YM

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM

ChemComp-HOH:
WATER

Source
  • severe acute respiratory syndrome coronavirus 2
KeywordsVIRAL PROTEIN / SARS-CoV-2 / Main protease / PF-07321332

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