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Structure paper

TitleDesign of a SARS-CoV-2 papain-like protease inhibitor with antiviral efficacy in a mouse model.
Journal, issue, pagesScience, Vol. 383, Page 1434-1440, Year 2024
Publish dateOct 19, 2023 (structure data deposition date)
AuthorsTan, B. / Zhang, X. / Ansari, A. / Jadhav, P. / Tan, H. / Li, K. / Chopra, A. / Ford, A. / Chi, X. / Ruiz, F.X. ...Tan, B. / Zhang, X. / Ansari, A. / Jadhav, P. / Tan, H. / Li, K. / Chopra, A. / Ford, A. / Chi, X. / Ruiz, F.X. / Arnold, E. / Deng, X. / Wang, J.
External linksScience / PubMed:38547259
MethodsX-ray diffraction
Resolution2.52 - 3.2 Å
Structure data

PDB-8uob:
SARS-CoV-2 Papain-like protease (PLpro) with Inhibitor Jun12682
Method: X-RAY DIFFRACTION / Resolution: 2.52 Å

PDB-8uuf:
SARS-CoV-2 papain-like protease (PLpro) with inhibitor Jun11941
Method: X-RAY DIFFRACTION / Resolution: 2.84 Å

PDB-8uug:
SARS-CoV-2 papain-like protease (PLpro) with inhibitor Jun12303
Method: X-RAY DIFFRACTION / Resolution: 2.74 Å

PDB-8uuh:
SARS-CoV-2 papain-like protease (PLpro) with inhibitor Jun12199
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

PDB-8uuu:
SARS-Cov-2 papain-like protease (PLpro) with inhibitor Jun12162
Method: X-RAY DIFFRACTION / Resolution: 3.01 Å

PDB-8uuv:
SARS-CoV-2 papain-like protease (PLpro) with inhibitor Jun12197
Method: X-RAY DIFFRACTION / Resolution: 3.01 Å

PDB-8uuw:
SARS-CoV-2 papain-like protease (PLpro) with inhibitor Jun12145
Method: X-RAY DIFFRACTION / Resolution: 3.2 Å

PDB-8uuy:
SARS-CoV-2 papain-like protease (PLpro) complex with inhibitor Jun12129
Method: X-RAY DIFFRACTION / Resolution: 3.05 Å

PDB-8uvm:
SARS-CoV-2 papain-like protease (PLpro) complex with covalent inhibitor Jun11313
Method: X-RAY DIFFRACTION / Resolution: 2.85 Å

Chemicals


ChemComp, No image

ChemComp-XB5:
Unknown entry

ChemComp-ZN:
Unknown entry

ChemComp-CL:
Unknown entry

ChemComp-HOH:
WATER


ChemComp, No image

ChemComp-XWO:
Unknown entry

ChemComp-ACT:
ACETATE ION


ChemComp, No image

ChemComp-XXW:
Unknown entry

ChemComp-GOL:
GLYCEROL


ChemComp, No image

ChemComp-XYI:
Unknown entry

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER


ChemComp, No image

ChemComp-XYR:
Unknown entry


ChemComp, No image

ChemComp-Y2I:
Unknown entry


ChemComp, No image

ChemComp-Y2N:
Unknown entry

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


ChemComp, No image

ChemComp-Y2R:
Unknown entry

ChemComp-PGE:
TRIETHYLENE GLYCOL


ChemComp, No image

ChemComp-Y3R:
Unknown entry

ChemComp-SO4:
SULFATE ION

Source
  • severe acute respiratory syndrome coronavirus 2
KeywordsVIRAL PROTEIN / HYDROLASE/INHIBITOR / Inhibitor / Noncovalent / Papain-like protease / SARS-COV-2 / VIRAL PROTEIN-INHIBITOR complex / HYDROLASE-INHIBITOR complex / SARS-CoV-2 Papain-Like protease / SARS CoV-2 Papain-Like protease / SARS CoV-2 Papain Like protease complex with Jun12199 / SARS CoV-2 Papain Like Protease (PLpro) complex with Jun12162 / SARS CoV-2 Papain Like Protease (PLpro) / complex / Jun12197 / Jun 12145 / SARS-CoV-2 papain-like protease (PLpro) / SARS CoV-2 Papain Like protease complex / Covalent inhibitor

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