4JU4
Crystal structure of hcv ns5b polymerase in complex with compound 22
Summary for 4JU4
Entry DOI | 10.2210/pdb4ju4/pdb |
Related | 3MWV 4JTW 4JTY 4JTZ 4JU1 4JU2 4JU3 4JU6 4JU7 4JVQ 4JY0 4JY1 |
Descriptor | Genome polyprotein, 2-{[(4-bromo-2-fluorophenyl)sulfonyl]amino}-5-phenoxybenzoic acid, MAGNESIUM ION, ... (4 entities in total) |
Functional Keywords | rna-directed rna polymerase, transferase, transferase-transferase inhibitor complex, transferase/transferase inhibitor |
Biological source | Hepatitis C virus (HCV) |
Cellular location | Core protein p21: Host endoplasmic reticulum membrane; Single-pass membrane protein (By similarity). Core protein p19: Virion (By similarity). Envelope glycoprotein E1: Virion membrane; Single-pass type I membrane protein (Potential). Envelope glycoprotein E2: Virion membrane; Single-pass type I membrane protein (Potential). p7: Host endoplasmic reticulum membrane; Multi-pass membrane protein (By similarity). Protease NS2-3: Host endoplasmic reticulum membrane; Multi-pass membrane protein (Potential). Serine protease NS3: Host endoplasmic reticulum membrane; Peripheral membrane protein (By similarity). Non-structural protein 4A: Host endoplasmic reticulum membrane; Single-pass type I membrane protein (Potential). Non-structural protein 4B: Host endoplasmic reticulum membrane; Multi-pass membrane protein (By similarity). Non-structural protein 5A: Host endoplasmic reticulum membrane; Peripheral membrane protein (By similarity). RNA-directed RNA polymerase: Host endoplasmic reticulum membrane; Single-pass type I membrane protein (Potential): O92972 |
Total number of polymer chains | 2 |
Total formula weight | 129552.44 |
Authors | Coulombe, R. (deposition date: 2013-03-24, release date: 2013-11-27, Last modification date: 2023-09-20) |
Primary citation | Stammers, T.A.,Coulombe, R.,Duplessis, M.,Fazal, G.,Gagnon, A.,Garneau, M.,Goulet, S.,Jakalian, A.,Laplante, S.,Rancourt, J.,Thavonekham, B.,Wernic, D.,Kukolj, G.,Beaulieu, P.L. Anthranilic acid-based Thumb Pocket 2 HCV NS5B polymerase inhibitors with sub-micromolar potency in the cell-based replicon assay. Bioorg.Med.Chem.Lett., 23:6879-6885, 2013 Cited by PubMed: 24176401DOI: 10.1016/j.bmcl.2013.09.102 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.4 Å) |
Structure validation
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