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Structure paper

TitleStructural and Functional Analyses of the Second-Generation Integrase Strand Transfer Inhibitor Dolutegravir (S/GSK1349572).
Journal, issue, pagesMol. Pharmacol., Vol. 80, Page 565-572, Year 2011
Publish dateMay 18, 2011 (structure data deposition date)
AuthorsHare, S. / Smith, S.J. / Metifiot, M. / Jaxa-Chamiec, A. / Pommier, Y. / Hughes, S.H. / Cherepanov, P.
External linksMol. Pharmacol. / PubMed:21719464
MethodsX-ray diffraction
Resolution2.49 - 2.55 Å
Structure data

PDB-3s3m:
Crystal structure of the Prototype Foamy Virus (PFV) intasome in complex with magnesium and Dolutegravir (S/GSK1349572)
Method: X-RAY DIFFRACTION / Resolution: 2.49 Å

PDB-3s3n:
Crystal structure of the Prototype Foamy Virus (PFV) S217H mutant intasome in complex with magnesium and Dolutegravir (S/GSK1349572)
Method: X-RAY DIFFRACTION / Resolution: 2.49 Å

PDB-3s3o:
Crystal structure of the Prototype Foamy Virus (PFV) N224H mutant intasome in complex with magnesium and Dolutegravir (S/GSK1349572)
Method: X-RAY DIFFRACTION / Resolution: 2.55 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-SO4:
SULFATE ION

ChemComp-GOL:
GLYCEROL

ChemComp-NH4:
AMMONIUM ION

ChemComp-MG:
Unknown entry

ChemComp-DLU:
(4R,12aS)-N-(2,4-difluorobenzyl)-7-hydroxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2H-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxamide / medication, antiretroviral*YM

ChemComp-HEZ:
HEXANE-1,6-DIOL

ChemComp-HOH:
WATER

Source
  • human spumaretrovirus
KeywordsRECOMBINATION/INHIBITOR/DNA / PROTEIN-DNA COMPLEX / TETRAMER / DNA INTEGRATION / ENDONUCLEASE / METAL-BINDING / MULTIFUNCTIONAL ENZYME / NUCLEASE / NUCLEOTIDYLTRANSFERASE / NUCLEUS / TRANSFERASE / VIRAL NUCLEOPROTEIN / VIRION / DNA-BINDING / ZINC BINDING / HHCC MOTIF / VIRAL PROTEIN / RECOMBINATION / INHIBITOR / RECOMBINATION-INHIBITOR-DNA complex / TRANSFERASE/INHIBITOR/DNA / TRANSFERASE-INHIBITOR-DNA complex

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