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Structure paper

TitleTwo Binding Sites of SARS-CoV-2 Macrodomain 3 Probed by Oxaprozin and Meclomen.
Journal, issue, pagesJ. Med. Chem., Vol. 65, Page 15227-15237, Year 2022
Publish dateMar 22, 2022 (structure data deposition date)
AuthorsLi, J. / Zhong, F. / Li, M. / Liu, Y. / Wang, L. / Liu, M. / Li, F. / Zhang, J. / Wu, J. / Shi, Y. ...Li, J. / Zhong, F. / Li, M. / Liu, Y. / Wang, L. / Liu, M. / Li, F. / Zhang, J. / Wu, J. / Shi, Y. / Zhang, Z. / Tu, X. / Ruan, K. / Gao, J.
External linksJ. Med. Chem. / PubMed:36356292
MethodsX-ray diffraction
Resolution1.7 - 2.1 Å
Structure data

PDB-7xc3:
Crystal structure of SARS-CoV-2 NSP3 Macrodomain 3 (SARS-unique domain-M)
Method: X-RAY DIFFRACTION / Resolution: 1.7 Å

PDB-7xc4:
Crystal structure of SARS-CoV-2 NSP3 Macrodomain 3 (SARS-unique domain-M) in complex with Oxaprozin
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

Chemicals

ChemComp-HOH:
WATER

ChemComp-BJ6:
3-(4,5-diphenyl-1,3-oxazol-2-yl)propanoic acid / antiinflammatory*YM

Source
  • severe acute respiratory syndrome coronavirus 2
KeywordsVIRAL PROTEIN / G-quadruplex-binding macrodomain / SARS-unique domain / G-quadruplex-binding

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