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TitleIn vitro selection of macrocyclic peptide inhibitors containing cyclic gamma 2,4 -amino acids targeting the SARS-CoV-2 main protease.
Journal, issue, pagesNat. Chem., Vol. 15, Page 998-1005, Year 2023
Publish dateMar 4, 2022 (structure data deposition date)
AuthorsMiura, T. / Malla, T.R. / Owen, C.D. / Tumber, A. / Brewitz, L. / McDonough, M.A. / Salah, E. / Terasaka, N. / Katoh, T. / Lukacik, P. ...Miura, T. / Malla, T.R. / Owen, C.D. / Tumber, A. / Brewitz, L. / McDonough, M.A. / Salah, E. / Terasaka, N. / Katoh, T. / Lukacik, P. / Strain-Damerell, C. / Mikolajek, H. / Walsh, M.A. / Kawamura, A. / Schofield, C.J. / Suga, H.
External linksNat. Chem. / PubMed:37217786
MethodsX-ray diffraction
Resolution1.7 Å
Structure data

PDB-7z4s:
Crystal structure of SARS-CoV-2 Mpro in complex with cyclic peptide GM4 including unnatural amino acids.
Method: X-RAY DIFFRACTION / Resolution: 1.7 Å

Chemicals

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER

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

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-PGE:
TRIETHYLENE GLYCOL

ChemComp-HOH:
WATER

Source
  • severe acute respiratory syndrome coronavirus 2
  • synthetic construct (others)
KeywordsUNKNOWN FUNCTION / protease

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