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TitleRVX-208, an inhibitor of BET transcriptional regulators with selectivity for the second bromodomain.
Journal, issue, pagesProc. Natl. Acad. Sci. USA, Vol. 110, Page 19754-19759, Year 2013
Publish dateSep 17, 2013 (structure data deposition date)
AuthorsPicaud, S. / Wells, C. / Felletar, I. / Brotherton, D. / Martin, S. / Savitsky, P. / Diez-Dacal, B. / Philpott, M. / Bountra, C. / Lingard, H. ...Picaud, S. / Wells, C. / Felletar, I. / Brotherton, D. / Martin, S. / Savitsky, P. / Diez-Dacal, B. / Philpott, M. / Bountra, C. / Lingard, H. / Fedorov, O. / Muller, S. / Brennan, P.E. / Knapp, S. / Filippakopoulos, P.
External linksProc. Natl. Acad. Sci. USA / PubMed:24248379
MethodsX-ray diffraction
Resolution1.63 - 1.68 Å
Structure data

PDB-4mr3:
Crystal Structure of the first bromodomain of human BRD4 in complex with a quinazolinone ligand (RVX-OH)
Method: X-RAY DIFFRACTION / Resolution: 1.68 Å

PDB-4mr4:
Crystal Structure of the first bromodomain of human BRD4 in complex with a quinazolinone ligand (RVX-208)
Method: X-RAY DIFFRACTION / Resolution: 1.66 Å

PDB-4mr5:
Crystal Structure of the second bromodomain of human BRD2 in complex with a quinazolinone ligand (RVX-OH)
Method: X-RAY DIFFRACTION / Resolution: 1.63 Å

PDB-4mr6:
Crystal Structure of the second bromodomain of human BRD2 in complex with a quinazolinone ligand (RVX-208)
Method: X-RAY DIFFRACTION / Resolution: 1.67 Å

Chemicals

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-1K0:
2-[4-(2-hydroxyethoxy)-3,5-dimethylphenyl]-5,7-dimethoxyquinazolin-4(3H)-one

ChemComp-HOH:
WATER

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM

Source
  • homo sapiens (human)
KeywordsTRANSCRIPTION/TRANSCRIPTION inhibitor / BRD4 / CAP / HUNK1 / MCAP / Mitotic chromosome associated protein / BRD / Small molecule inhibitor / RVX-OH / Structural Genomics Consortium / SGC / TRANSCRIPTION-TRANSCRIPTION inhibitor complex / RVX-208 / BRD2 / RING3 / inhibitor complex

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