9NMG

SARS-CoV-2 3CLPro in complex with 8-(2,5-dihydro-1H-pyrrol-3-yl)-2-hydroxy-3-(4-isoquinolyl)-6-(trifluoromethyl)-1H-quinolin-4-one

This is a non-PDB format compatible entry.

Summary for 9NMG

• Entry DOI: 10.2210/pdb9nmg/pdb
• Descriptor: Glutathione S-transferase class-mu 26 kDa isozyme,Replicase polyprotein 1ab, (3P,8P)-8-(2,5-dihydro-1H-pyrrol-3-yl)-2-hydroxy-3-(isoquinolin-4-yl)-6-(trifluoromethyl)quinolin-4(1H)-one (3 entities in total)
• Functional Keywords: protease, inhibitor, viral protein, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Severe acute respiratory syndrome coronavirus 2; More
• Total number of polymer chains: 2
• Total formula weight: 125007.02

Authors

Goins, C.M.,Stauffer, S.R. (deposition date: 2025-03-04, release date: 2026-03-18)

• Primary citation: Goins, C.M.,Stauffer, S.R.,Rodzinak, K.; Structure Based Design of non-covalent, non-peptidic inhibitors of SARS-CoV-2 Main Protease; To Be Published,

Experimental method

X-RAY DIFFRACTION (2 Å)