Unraveling the catalytic mechanism of SARS-CoV-2 papain-like protease with allosteric modulation of C270 mutation using multiscale computational approaches

Papain-like protease (PL(pro)) is a promising therapeutic target against SARS-CoV-2, but its restricted S1/S2 subsites pose an obstacle in developing active site-directed inhibitors. We have recently identified C270 as a novel covalent allosteric site for SARS-CoV-2 PL(pro) inhibitors. Here we prese...

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Detalles Bibliográficos
Autores principales: Shao, Qiang, Xiong, Muya, Li, Jiameng, Hu, Hangchen, Su, Haixia, Xu, Yechun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2023
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10171076/
https://www.ncbi.nlm.nih.gov/pubmed/37181765
http://dx.doi.org/10.1039/d3sc00166k

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10171076/
https://www.ncbi.nlm.nih.gov/pubmed/37181765
http://dx.doi.org/10.1039/d3sc00166k

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