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TitleAssessment of Bromodomain Target Engagement by a Series of BI2536 Analogues with Miniaturized BET-BRET.
Journal, issue, pagesChemMedChem, Vol. 11, Page 2575-2581, Year 2016
Publish dateJun 17, 2016 (structure data deposition date)
AuthorsKoblan, L.W. / Buckley, D.L. / Ott, C.J. / Fitzgerald, M.E. / Ember, S.W. / Zhu, J.Y. / Liu, S. / Roberts, J.M. / Remillard, D. / Vittori, S. ...Koblan, L.W. / Buckley, D.L. / Ott, C.J. / Fitzgerald, M.E. / Ember, S.W. / Zhu, J.Y. / Liu, S. / Roberts, J.M. / Remillard, D. / Vittori, S. / Zhang, W. / Schonbrunn, E. / Bradner, J.E.
External linksChemMedChem / PubMed:27862999
MethodsX-ray diffraction
Resolution1.51 Å
Structure data

PDB-5kj0:
CRYSTAL STRUCTURE OF THE FIRST BROMODOMAIN OF HUMAN BRD4 IN COMPLEX WITH DB-1-264-2
Method: X-RAY DIFFRACTION / Resolution: 1.51 Å

Chemicals

ChemComp-6TB:
4-[[(7~{R})-8-cyclopentyl-7-ethyl-5-methyl-6-oxidanylidene-7~{H}-pteridin-2-yl]-methyl-amino]-3-methoxy-~{N}-(1-methylpiperidin-4-yl)benzamide

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSCRIPTION/INHIBITOR / BROMODOMAIN / CAP / HUNK1 / MCAP / PROTEIN BINDING-INHIBITOR COMPLEX / MITOTIC CHROMOSOME ASSOCIATED PROTEIN / CELL CYCLE / INHIBITOR / TRANSCRIPTION-INHIBITOR COMPLEX

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