5E0H
1.95 A resolution structure of Norovirus 3CL protease in complex with a triazole-based macrocyclic (18-mer) inhibitor
Summary for 5E0H
Entry DOI | 10.2210/pdb5e0h/pdb |
Related | 5E0G 5E0J |
Related PRD ID | PRD_002202 |
Descriptor | Norovirus 3C-like protease, (phenylmethyl) ~{N}-[(9~{S},12~{S},15~{S})-9-(hydroxymethyl)-12-(2-methylpropyl)-6,11,14-tris(oxidanylidene)-1,5,10,13,18,19-hexazabicyclo[15.2.1]icosa-17(20),18-dien-15-yl]carbamate, GLYCEROL, ... (4 entities in total) |
Functional Keywords | protease, norovirus, norwalk virus, antiviral inhibitors, triazole macrocyclic inhibitor, cell permeable, protease-protease inhibitor complex, protease/protease inhibitor |
Biological source | Norwalk virus (Hu/NV/NV/1968/US) |
Total number of polymer chains | 2 |
Total formula weight | 40902.00 |
Authors | Lovell, S.,Battaile, K.P.,Mehzabeen, N.,Weerawarna, P.M.,Kim, Y.,Kankanamalage, A.C.G.,Damalanka, V.C.,Lushington, G.H.,Alliston, K.R.,Chang, K.-O.,Groutas, W.C. (deposition date: 2015-09-28, release date: 2016-05-04, Last modification date: 2023-09-27) |
Primary citation | Weerawarna, P.M.,Kim, Y.,Galasiti Kankanamalage, A.C.,Damalanka, V.C.,Lushington, G.H.,Alliston, K.R.,Mehzabeen, N.,Battaile, K.P.,Lovell, S.,Chang, K.O.,Groutas, W.C. Structure-based design and synthesis of triazole-based macrocyclic inhibitors of norovirus protease: Structural, biochemical, spectroscopic, and antiviral studies. Eur.J.Med.Chem., 119:300-318, 2016 Cited by PubMed: 27235842DOI: 10.1016/j.ejmech.2016.04.013 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.95 Å) |
Structure validation
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