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TitleOptimization of Naphthyridones into Selective TATA-Binding Protein Associated Factor 1 (TAF1) Bromodomain Inhibitors.
Journal, issue, pagesAcs Med. Chem. Lett., Vol. 12, Page 1308-1317, Year 2021
Publish dateJul 13, 2021 (structure data deposition date)
AuthorsClegg, M.A. / Theodoulou, N.H. / Bamborough, P. / Chung, C.W. / Craggs, P.D. / Demont, E.H. / Gordon, L.J. / Liwicki, G.M. / Phillipou, A. / Tomkinson, N.C.O. ...Clegg, M.A. / Theodoulou, N.H. / Bamborough, P. / Chung, C.W. / Craggs, P.D. / Demont, E.H. / Gordon, L.J. / Liwicki, G.M. / Phillipou, A. / Tomkinson, N.C.O. / Prinjha, R.K. / Humphreys, P.G.
External linksAcs Med. Chem. Lett. / PubMed:34413961
MethodsX-ray diffraction
Resolution2.17 Å
Structure data

PDB-7p4s:
BROMODOMAIN OF HUMAN TAF1 (2) WITH naphthyridinone compound
Method: X-RAY DIFFRACTION / Resolution: 2.17 Å

Chemicals

ChemComp-5LV:
8-[[1-(3-azanylpropyl)piperidin-4-yl]amino]-5-[5-(hydroxymethyl)pyridin-3-yl]-3-methyl-1~{H}-1,7-naphthyridin-2-one

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSCRIPTION / second bromodomain of TAF1 / inhibitor-bound / complex

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