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TitleSynthesis and evaluation of substituted benzoisoquinolinones as potent inhibitors of Chk1 kinase.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 17, Page 6280-6285, Year 2007
Publish dateAug 21, 2007 (structure data deposition date)
AuthorsGarbaccio, R.M. / Huang, S. / Tasber, E.S. / Fraley, M.E. / Yan, Y. / Munshi, S. / Ikuta, M. / Kuo, L. / Kreatsoulas, C. / Stirdivant, S. ...Garbaccio, R.M. / Huang, S. / Tasber, E.S. / Fraley, M.E. / Yan, Y. / Munshi, S. / Ikuta, M. / Kuo, L. / Kreatsoulas, C. / Stirdivant, S. / Drakas, B. / Rickert, K. / Walsh, E.S. / Hamilton, K.A. / Buser, C.A. / Hardwick, J. / Mao, X. / Beck, S.C. / Abrams, M.T. / Tao, W. / Lobell, R. / Sepp-Lorenzino, L. / Hartman, G.D.
External linksBioorg. Med. Chem. Lett. / PubMed:17900896
MethodsX-ray diffraction
Resolution1.9 Å
Structure data

PDB-2r0u:
Crystal Structure of Chek1 in Complex with Inhibitor 54
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

Chemicals

ChemComp-M54:
6-(3-aminopropyl)-4-(3-hydroxyphenyl)-9-(1H-pyrazol-4-yl)benzo[h]isoquinolin-1(2H)-one

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / Chek1 / Kinase / cell cycle check point / ATP-binding / Cytoplasm / DNA damage / DNA repair / Nucleotide-binding / Nucleus / Phosphorylation / Polymorphism / Serine/threonine-protein kinase / Ubl conjugation

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