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TitleGain-of-Signal Assays for Probing Inhibition of SARS-CoV-2 M pro /3CL pro in Living Cells.
Journal, issue, pagesMbio, Vol. 13, Page e0078422-e0078422, Year 2022
Publish dateJan 9, 2022 (structure data deposition date)
AuthorsMoghadasi, S.A. / Esler, M.A. / Otsuka, Y. / Becker, J.T. / Moraes, S.N. / Anderson, C.B. / Chamakuri, S. / Belica, C. / Wick, C. / Harki, D.A. ...Moghadasi, S.A. / Esler, M.A. / Otsuka, Y. / Becker, J.T. / Moraes, S.N. / Anderson, C.B. / Chamakuri, S. / Belica, C. / Wick, C. / Harki, D.A. / Young, D.W. / Scampavia, L. / Spicer, T.P. / Shi, K. / Aihara, H. / Brown, W.L. / Harris, R.S.
External linksMbio / PubMed:35471084
MethodsX-ray diffraction
Resolution1.68 Å
Structure data

PDB-7tgr:
Structure of SARS-CoV-2 main protease in complex with GC376
Method: X-RAY DIFFRACTION / Resolution: 1.68 Å

Chemicals

ChemComp-K36:
(1S,2S)-2-({N-[(benzyloxy)carbonyl]-L-leucyl}amino)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid

ChemComp-B1S:
(1R,2S)-2-({N-[(benzyloxy)carbonyl]-L-leucyl}amino)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-CL:
Unknown entry

ChemComp-K:
Unknown entry

ChemComp-NA:
Unknown entry

ChemComp-HOH:
WATER

Source
  • severe acute respiratory syndrome coronavirus 2
KeywordsHYDROLASE / Protease / Inhibitor / Complex

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