Structure-Guided Design of Potent Inhibitors of SARS-CoV-2 3CL Protease: Structural, Biochemical, and Cell-Based Studies.

Autor: Dampalla CS; Department of Chemistry, Wichita State University, Wichita, Kansas 67260, United States., Rathnayake AD; Department of Chemistry, Wichita State University, Wichita, Kansas 67260, United States., Perera KD; Department of Diagnostic Medicine & Pathobiology, College of Veterinary Medicine, Kansas State University, Manhattan, Kansas 66506, United States., Jesri AM; Department of Chemistry, Wichita State University, Wichita, Kansas 67260, United States., Nguyen HN; Department of Chemistry, Wichita State University, Wichita, Kansas 67260, United States., Miller MJ; Department of Chemistry, Wichita State University, Wichita, Kansas 67260, United States., Thurman HA; Department of Chemistry, Wichita State University, Wichita, Kansas 67260, United States., Zheng J; Department of Microbiology and Immunology, University of Iowa, Iowa City, Iowa 52242, United States., Kashipathy MM; Protein Structure Laboratory, The University of Kansas, Lawrence, Kansas 66047, United States., Battaile KP; NYX, New York Structural Biology Center, Upton, New York 11973, United States., Lovell S; Protein Structure Laboratory, The University of Kansas, Lawrence, Kansas 66047, United States., Perlman S; Department of Microbiology and Immunology, University of Iowa, Iowa City, Iowa 52242, United States., Kim Y; Department of Diagnostic Medicine & Pathobiology, College of Veterinary Medicine, Kansas State University, Manhattan, Kansas 66506, United States., Groutas WC; Department of Chemistry, Wichita State University, Wichita, Kansas 67260, United States., Chang KO; Department of Diagnostic Medicine & Pathobiology, College of Veterinary Medicine, Kansas State University, Manhattan, Kansas 66506, United States.

Publikováno v: Journal of medicinal chemistry [J Med Chem] 2021 Dec 23; Vol. 64 (24), pp. 17846-17865. Date of Electronic Publication: 2021 Dec 05.