7NTQ
Crystal structure of the SARS-CoV-2 Main Protease complexed with N-(pyridin-3-ylmethyl)thioformamide
Summary for 7NTQ
Entry DOI | 10.2210/pdb7ntq/pdb |
Related | 7NTS 7NTT 7NTW |
Descriptor | 3C-like proteinase, N-(pyridin-3-ylmethyl)thioformamide, SODIUM ION, ... (6 entities in total) |
Functional Keywords | 3clpro, main protease, sars-cov-2, 2019-ncov, inhibitor, viral protein |
Biological source | Severe acute respiratory syndrome coronavirus 2 (2019-nCoV, SARS-CoV-2) |
Total number of polymer chains | 1 |
Total formula weight | 34759.57 |
Authors | Dupre, E.,Villeret, V.,Hanoulle, X. (deposition date: 2021-03-10, release date: 2022-03-02, Last modification date: 2024-02-07) |
Primary citation | Brier, L.,Hassan, H.,Hanoulle, X.,Landry, V.,Moschidi, D.,Desmarets, L.,Rouille, Y.,Dumont, J.,Herledan, A.,Warenghem, S.,Piveteau, C.,Carre, P.,Ikherbane, S.,Cantrelle, F.X.,Dupre, E.,Dubuisson, J.,Belouzard, S.,Leroux, F.,Deprez, B.,Charton, J. Novel dithiocarbamates selectively inhibit 3CL protease of SARS-CoV-2 and other coronaviruses. Eur.J.Med.Chem., 250:115186-115186, 2023 Cited by PubMed: 36796300DOI: 10.1016/j.ejmech.2023.115186 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.495 Å) |
Structure validation
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