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4TLR

NS5b in complex with lactam-thiophene carboxylic acids

Summary for 4TLR
Entry DOI10.2210/pdb4tlr/pdb
DescriptorNS5b, 3-{(2R,5R)-5-cyclohexyl-2-[(2R)-2-hydroxypropyl]-3-oxomorpholin-4-yl}-5-(3,3-dimethylbut-1-yn-1-yl)thiophene-2-carboxylic acid, 5-cyclopropyl-2-(4-fluorophenyl)-6-[(2-hydroxyethyl)(methylsulfonyl)amino]-N-methyl-1-benzofuran-3-carboxamide, ... (4 entities in total)
Functional Keywordscomplex polymerase inhbitor, hydrolase
Biological sourceHepatitis C virus (isolate 1)
Total number of polymer chains1
Total formula weight65330.99
Authors
Chopra, R. (deposition date: 2014-05-30, release date: 2014-12-10, Last modification date: 2023-12-27)
Primary citationBarnes-Seeman, D.,Boiselle, C.,Capacci-Daniel, C.,Chopra, R.,Hoffmaster, K.,Jones, C.T.,Kato, M.,Lin, K.,Ma, S.,Pan, G.,Shu, L.,Wang, J.,Whiteman, L.,Xu, M.,Zheng, R.,Fu, J.
Design and synthesis of lactam-thiophene carboxylic acids as potent hepatitis C virus polymerase inhibitors.
Bioorg.Med.Chem.Lett., 24:3979-3985, 2014
Cited by
PubMed: 24986660
DOI: 10.1016/j.bmcl.2014.06.031
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.86 Å)
Structure validation

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