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Structure paper

TitleDiscovery, synthesis and biological evaluation of isoquinolones as novel and highly selective JNK inhibitors (2)
Journal, issue, pagesBioorg. Med. Chem., Vol. 16, Page 4699-4714, Year 2008
Publish dateNov 27, 2007 (structure data deposition date)
AuthorsAsano, Y. / Kitamura, S. / Ohra, T. / Itoh, F. / Kajino, M. / Tamura, T. / Kaneko, M. / Ikeda, S. / Igata, H. / Kawamoto, T. ...Asano, Y. / Kitamura, S. / Ohra, T. / Itoh, F. / Kajino, M. / Tamura, T. / Kaneko, M. / Ikeda, S. / Igata, H. / Kawamoto, T. / Sogabe, S. / Matsumoto, S. / Tanaka, T. / Yamaguchi, M. / Kimura, H. / Fukumoto, S.
External linksBioorg. Med. Chem. / PubMed:18313930
MethodsX-ray diffraction
Resolution2 Å
Structure data

PDB-2zdt:
Crystal Structure of human JNK3 complexed with an isoquinolone inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-46C:
4-[(6-chloro-1-oxo-4-phenyl-3-propanoylisoquinolin-2(1H)-yl)methyl]benzoic acid

ChemComp-GOL:
GLYCEROL

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / PROTEIN KINASE / ATP-binding / Epilepsy / Nucleotide-binding / Phosphoprotein / Serine/threonine-protein kinase

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