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Structure paper

TitleSnapshot of the equilibrium dynamics of a drug bound to HIV-1 reverse transcriptase.
Journal, issue, pagesNat Chem, Vol. 5, Page 174-181, Year 2013
Publish dateJul 11, 2012 (structure data deposition date)
AuthorsKuroda, D.G. / Bauman, J.D. / Challa, J.R. / Patel, D. / Troxler, T. / Das, K. / Arnold, E. / Hochstrasser, R.M.
External linksNat Chem / PubMed:23422558
MethodsX-ray diffraction
Resolution1.51 Å
Structure data

PDB-4g1q:
Crystal structure of HIV-1 reverse transcriptase (RT) in complex with Rilpivirine (TMC278, Edurant), a non-nucleoside rt-inhibiting drug
Method: X-RAY DIFFRACTION / Resolution: 1.51 Å

Chemicals

ChemComp-T27:
4-{[4-({4-[(E)-2-cyanoethenyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile / medication*YM

ChemComp-SO4:
SULFATE ION

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-MG:
Unknown entry

ChemComp-HOH:
WATER

Source
  • human immunodeficiency virus type 1
KeywordsTRANSFERASE / HYDROLASE/INHIBITOR / P51/P66 / HETERO DIMER / NNRTI / NONNUCLEOSIDE INHIBITOR / AIDS / HIV / R278474 / DIARYLPYRIMIDINE / DAPY / DNA RECOMBINATION / RNA-DIRECTED DNA POLYMERASE / DNA POLYMERASE / ENDONUCLEASE / HYDROLASE / MULTIFUNCTIONAL ENZYME / HYDROLASE-INHIBITOR complex

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