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Structure paper

TitleDiscovery of azabenzimidazole derivatives as potent, selective inhibitors of TBK1/IKK epsilon kinases.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 22, Page 2063-2069, Year 2012
Publish dateNov 10, 2011 (structure data deposition date)
AuthorsWang, T. / Block, M.A. / Cowen, S. / Davies, A.M. / Devereaux, E. / Gingipalli, L. / Johannes, J. / Larsen, N.A. / Su, Q. / Tucker, J.A. ...Wang, T. / Block, M.A. / Cowen, S. / Davies, A.M. / Devereaux, E. / Gingipalli, L. / Johannes, J. / Larsen, N.A. / Su, Q. / Tucker, J.A. / Whitston, D. / Wu, J. / Zhang, H.J. / Zinda, M. / Chuaqui, C.
External linksBioorg. Med. Chem. Lett. / PubMed:22305584
MethodsX-ray diffraction
Resolution2 Å
Structure data

PDB-3uli:
Human Cyclin Dependent Kinase 2 (CDK2) bound to azabenzimidazole derivative
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-1N3:
1-(aminomethyl)-N-(3-{[6-bromo-2-(4-methoxyphenyl)-3H-imidazo[4,5-b]pyridin-7-yl]amino}propyl)cyclopropanecarboxamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / azabenzimidazole derivative / Phosphotransfer / Complex with Cyclin A or Cyclin E / TRANSFERASE-TRANSFERASE INHIBITOR complex

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