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9CJS

X-ray crystal structure of SARS-CoV-2 main protease triple mutants in complex with Bofutrelvir

Summary for 9CJS
Entry DOI10.2210/pdb9cjs/pdb
Descriptor3C-like proteinase nsp5, ~{N}-[(2~{S})-3-cyclohexyl-1-oxidanylidene-1-[[(2~{S})-1-oxidanylidene-3-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]propan-2-yl]-1~{H}-indole-2-carboxamide (3 entities in total)
Functional Keywordshydrolase-inhibitor complex, sars2, hydrolase/inhibitor
Biological sourceSevere acute respiratory syndrome coronavirus 2
Total number of polymer chains1
Total formula weight34018.88
Authors
Esler, M.A.,Shi, K.,Harris, R.S.,Aihara, H. (deposition date: 2024-07-07, release date: 2025-07-09)
Primary citationEsler, M.A.,Shi, K.,Harris, R.S.,Aihara, H.
X-ray crystal structure of SARS-CoV-2 main protease triple mutants in complex with Bofutrelvir
To Be Published,
Experimental method
X-RAY DIFFRACTION (2.09 Å)
Structure validation

238582

PDB entries from 2025-07-09

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