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PDB: 2 results

8W1U
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BU of 8w1u by Molmil
SARS-CoV-2 Main protease bound to non-covalent lead molecule NZ-804
Descriptor: 11-[1-(1H-pyrrolo[3,2-c]pyridine-7-carbonyl)piperidin-4-ylidene]-6,11-dihydro-5H-5lambda~6~-dibenzo[b,e]thiepine-5,5-dione, 3C-like proteinase nsp5, DIMETHYL SULFOXIDE
Authors:Bian, X, Tang, S, Sacchettini, J.C.
Deposit date:2024-02-18
Release date:2024-11-20
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:An oral non-covalent non-peptidic inhibitor of SARS-CoV-2 Mpro ameliorates viral replication and pathogenesis in vivo.
Cell Rep, 43, 2024
8W1T
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BU of 8w1t by Molmil
SARS-CoV-2 Main protease bound to a non-covalent non-peptidic HTS hit
Descriptor: (5-bromopyridin-3-yl){4-[(R)-(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}methanone, (5-bromopyridin-3-yl){4-[(S)-(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}methanone, 1,2-ETHANEDIOL, ...
Authors:Bian, X, Tang, S, Sacchettini, J.C.
Deposit date:2024-02-18
Release date:2024-11-20
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:An oral non-covalent non-peptidic inhibitor of SARS-CoV-2 Mpro ameliorates viral replication and pathogenesis in vivo.
Cell Rep, 43, 2024

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