6W5H
1.85 A resolution structure of Norovirus 3CL protease in complex with inhibitor 5d
Summary for 6W5H
| Entry DOI | 10.2210/pdb6w5h/pdb |
| Related PRD ID | PRD_002452 |
| Descriptor | 3C-LIKE PROTEASE, 2-(3-chlorophenyl)-2-methylpropyl [(2S)-3-cyclohexyl-1-({(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}amino)-1-oxopropan-2-yl]carbamate (3 entities in total) |
| Functional Keywords | protease, norovirus 3cl protease, inhhibitors, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
| Biological source | Norwalk virus (strain GI/Human/United States/Norwalk/1968) (Hu/NV/NV/1968/US) |
| Total number of polymer chains | 4 |
| Total formula weight | 82068.04 |
| Authors | Lovell, S.,Kashipathy, M.M.,Battaile, K.P.,Rathnayake, A.D.,Kim, Y.,Chang, K.O.,Groutas, W.C. (deposition date: 2020-03-13, release date: 2020-09-30, Last modification date: 2023-10-18) |
| Primary citation | Rathnayake, A.D.,Kim, Y.,Dampalla, C.S.,Nguyen, H.N.,Jesri, A.M.,Kashipathy, M.M.,Lushington, G.H.,Battaile, K.P.,Lovell, S.,Chang, K.O.,Groutas, W.C. Structure-Guided Optimization of Dipeptidyl Inhibitors of Norovirus 3CL Protease. J.Med.Chem., 63:11945-11963, 2020 Cited by PubMed: 32945669DOI: 10.1021/acs.jmedchem.0c01252 PDB entries with the same primary citation |
| Experimental method | X-RAY DIFFRACTION (1.85 Å) |
Structure validation
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