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TitlePicomolar Inhibitors of HIV-1 Reverse Transcriptase: Design and Crystallography of Naphthyl Phenyl Ethers.
Journal, issue, pagesAcs Med. Chem. Lett., Vol. 5, Page 1259-1262, Year 2014
Publish dateSep 9, 2014 (structure data deposition date)
AuthorsLee, W.G. / Frey, K.M. / Gallardo-Macias, R. / Spasov, K.A. / Bollini, M. / Anderson, K.S. / Jorgensen, W.L.
External linksAcs Med. Chem. Lett. / PubMed:25408842
MethodsX-ray diffraction
Resolution2.491 Å
Structure data

PDB-4we1:
Crystal Structure of HIV-1 Reverse Transcriptase in Complex with 5-(2-(2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy)phenoxy)-2-naphthonitrile (JLJ600)
Method: X-RAY DIFFRACTION / Resolution: 2.491 Å

Chemicals

ChemComp-3LQ:
5-{2-[2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy]phenoxy}naphthalene-2-carbonitrile

ChemComp-MG:
Unknown entry

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

Source
  • human immunodeficiency virus type 1 group m subtype b
KeywordsHYDROLASE / Polymerase / transferase / RnaseH / Rnase

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