PDB Search results for query - Protein Data Bank Japan

PDB: 3 results

Room temperature X-ray structure of SARS-CoV-2 main protease in complex with compound Z199538122
Descriptor:	1-{4-[(naphthalen-1-yl)methyl]piperazin-1-yl}ethan-1-one, 3C-like proteinase
Authors:	Kovalevsky, A.Y, Coates, L, Kneller, D.W.
Deposit date:	2022-07-07
Release date:	2023-05-17
Last modified:	2024-10-30
Method:	X-RAY DIFFRACTION (1.9 Å)
Cite:	AI-Accelerated Design of Targeted Covalent Inhibitors for SARS-CoV-2. J.Chem.Inf.Model., 63, 2023

Room temperature X-ray structure of SARS-CoV-2 main protease in complex with compound Z2799209083
Descriptor:	1-[(5S)-5-(3,4-dimethoxyphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one, 3C-like proteinase
Authors:	Kovalevsky, A.Y, Coates, L, Kneller, D.W.
Deposit date:	2022-07-07
Release date:	2023-05-17
Last modified:	2024-10-23
Method:	X-RAY DIFFRACTION (1.9 Å)
Cite:	AI-Accelerated Design of Targeted Covalent Inhibitors for SARS-CoV-2. J.Chem.Inf.Model., 63, 2023

Room temperature X-ray structure of SARS-CoV-2 main protease in complex with compound ZZ4461624291
Descriptor:	1-[(3R)-4-[(3-chlorophenyl)methyl]-3-(2-methylpropyl)piperazin-1-yl]ethan-1-one, 3C-like proteinase
Authors:	Kovalevsky, A, Coates, L, Kneller, D.W.
Deposit date:	2022-07-08
Release date:	2023-05-17
Last modified:	2024-10-30
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	AI-Accelerated Design of Targeted Covalent Inhibitors for SARS-CoV-2. J.Chem.Inf.Model., 63, 2023