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TitleStructure of a Dihydroxycoumarin Active-Site Inhibitor in Complex with the RNase H Domain of HIV-1 Reverse Transcriptase and Structure-Activity Analysis of Inhibitor Analogs.
Journal, issue, pagesJ. Mol. Biol., Vol. 426, Page 2617-2631, Year 2014
Publish dateMay 4, 2014 (structure data deposition date)
AuthorsHimmel, D.M. / Myshakina, N.S. / Ilina, T. / Van Ry, A. / Ho, W.C. / Parniak, M.A. / Arnold, E.
External linksJ. Mol. Biol. / PubMed:24840303
MethodsX-ray diffraction
Resolution1.712 Å
Structure data

PDB-4qag:
Structure of a dihydroxycoumarin active-site inhibitor in complex with the RNASE H domain of HIV-1 reverse transcriptase
Method: X-RAY DIFFRACTION / Resolution: 1.712 Å

Chemicals

ChemComp-MN:
Unknown entry

ChemComp-F95:
(7,8-dihydroxy-2-oxo-2H-chromen-4-yl)acetic acid

ChemComp-HOH:
WATER

Source
  • human immunodeficiency virus type 1
KeywordsHYDROLASE/HYDROLASE INHIBITOR / RNASE H INHIBITOR / STRUCTURE-BASED DRUG DESIGN / ACTIVE SITE / TRANSFERASE / DIHYDROXYCOUMARIN ANALOGS / DIHYDROXY-BENZOPYRONE DERIVATIVES / DIVALENT CATION CHELATOR / AIDS / REVERSE TRANSCRIPTASE / PROTEIN-INHIBITOR COMPLEX / HYDROLASE-HYDROLASE INHIBITOR complex

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