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TitlePeptidyl Nitroalkenes Inhibit SARS-CoV-2 Main Protease and Block Virus Replication
Journal, issue, pagesTo Be Published
Publish dateOct 26, 2022 (structure data deposition date)
AuthorsMedrano, F.J. / Romero, A.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.621 - 1.99 Å
Structure data

PDB-8bfo:
Structure of the apo form of Mpro from SARS-CoV-2
Method: X-RAY DIFFRACTION / Resolution: 1.99 Å

PDB-8bfq:
Structure of the apo form of Mpro from SARS-CoV-2
Method: X-RAY DIFFRACTION / Resolution: 1.863 Å

PDB-8bgd:
Structure of Mpro from SARS-CoV-2 in complex with FGA147
Method: X-RAY DIFFRACTION / Resolution: 1.621 Å

Chemicals

ChemComp-HOH:
WATER

ChemComp-QH0:
(phenylmethyl) N-[(2S)-4-methyl-1-[[(2S)-4-nitro-1-[(3R)-2-oxidanylidenepyrrolidin-3-yl]butan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]carbamate

Source
  • severe acute respiratory syndrome coronavirus 2
KeywordsVIRAL PROTEIN / Mpro / SARS-CoV-2 / FGA147

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