7VLI
Crystal structure of Zika NS2B-NS3 protease with compound MI2220
Summary for 7VLI
Entry DOI | 10.2210/pdb7vli/pdb |
Descriptor | Serine protease subunit NS2B, NS3 protease, 1-[(3~{S},6~{S},19~{R})-3,6-bis(4-azanylbutyl)-2,5,8,12,15,18-hexakis(oxidanylidene)-1,4,7,11,14,17-hexazacyclotricos-19-yl]guanidine, ... (5 entities in total) |
Functional Keywords | ns3 protease, viral protein |
Biological source | Zika virus (ZIKV) More |
Total number of polymer chains | 2 |
Total formula weight | 25610.78 |
Authors | Quek, J.P. (deposition date: 2021-10-02, release date: 2022-08-10, Last modification date: 2023-11-29) |
Primary citation | Huber, S.,Braun, N.J.,Schmacke, L.C.,Quek, J.P.,Murra, R.,Bender, D.,Hildt, E.,Luo, D.,Heine, A.,Steinmetzer, T. Structure-Based Optimization and Characterization of Macrocyclic Zika Virus NS2B-NS3 Protease Inhibitors. J.Med.Chem., 65:6555-6572, 2022 Cited by PubMed: 35475620DOI: 10.1021/acs.jmedchem.1c01860 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.385 Å) |
Structure validation
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