5CZB

HCV NS5B IN COMPLEX WITH LIGAND IDX17119-5

Summary for 5CZB

• Entry DOI: 10.2210/pdb5czb/pdb
• Descriptor: NS5B, 1-[4-(7-amino-5-methylpyrazolo[1,5-a]pyrimidin-2-yl)phenyl]-3-{[(R)-(2,4-dimethylphenyl)(methoxy)phosphoryl]amino}-1H-pyrazole-4-carboxylic acid, GLYCEROL, ... (7 entities in total)
• Functional Keywords: hcv polymerase, idenix, inhibitor, proteros biostructures gmbh, replication
• Biological source: Hepatitis C virus subtype 1b (HCV)
• Cellular location: Core protein p21: Host endoplasmic reticulum membrane ; Single-pass membrane protein . Core protein p19: Virion . Envelope glycoprotein E1: Virion membrane ; Single-pass type I membrane protein . Envelope glycoprotein E2: Virion membrane ; Single-pass type I membrane protein . p7: Host endoplasmic reticulum membrane ; Multi-pass membrane protein . Protease NS2-3: Host endoplasmic reticulum membrane ; Multi-pass membrane protein . Serine protease NS3: Host endoplasmic reticulum membrane ; Peripheral membrane protein . Non-structural protein 4A: Host endoplasmic reticulum membrane ; Single-pass type I membrane protein . Non-structural protein 4B: Host endoplasmic reticulum membrane ; Multi-pass membrane protein . Non-structural protein 5A: Host endoplasmic reticulum membrane ; Peripheral membrane protein . RNA-directed RNA polymerase: Host endoplasmic reticulum membrane ; Single-pass type I membrane protein : O92972
• Total number of polymer chains: 2
• Total formula weight: 129021.89

Authors

Pierra, C.,Dousson, C.,Augustin, M. (deposition date: 2015-07-31, release date: 2016-06-15, Last modification date: 2016-09-07)

• Primary citation: Pierra Rouviere, C.,Amador, A.,Badaroux, E.,Convard, T.,Da Costa, D.,Dukhan, D.,Griffe, L.,Griffon, J.F.,LaColla, M.,Leroy, F.,Liuzzi, M.,Loi, A.G.,McCarville, J.,Mascia, V.,Milhau, J.,Onidi, L.,Paparin, J.L.,Rahali, R.,Sais, E.,Seifer, M.,Surleraux, D.,Standring, D.,Dousson, C.; Synthesis of potent and broad genotypically active NS5B HCV non-nucleoside inhibitors binding to the thumb domain allosteric site 2 of the viral polymerase.; Bioorg.Med.Chem.Lett., 26:4536-4541, 2016; PubMed: 27520942; DOI: 10.1016/j.bmcl.2016.01.042

Experimental method

X-RAY DIFFRACTION (1.96 Å)