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Structure paper

TitleImidazo[1,2-a]pyridin-6-yl-benzamide analogs as potent RAF inhibitors.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 27, Page 5221-5224, Year 2017
Publish dateJan 30, 2017 (structure data deposition date)
AuthorsSmith, A. / Ni, Z.J. / Poon, D. / Huang, Z. / Chen, Z. / Zhang, Q. / Tandeske, L. / Merritt, H. / Shoemaker, K. / Chan, J. ...Smith, A. / Ni, Z.J. / Poon, D. / Huang, Z. / Chen, Z. / Zhang, Q. / Tandeske, L. / Merritt, H. / Shoemaker, K. / Chan, J. / Kaufman, S. / Huh, K. / Murray, J. / Appleton, B.A. / Cowan-Jacob, S.W. / Scheufler, C. / Kanazawa, T. / Jansen, J.M. / Stuart, D. / Shafer, C.M.
External linksBioorg. Med. Chem. Lett. / PubMed:29107542
MethodsX-ray diffraction
Resolution2.15 - 2.68 Å
Structure data

PDB-5mz3:
P38 ALPHA MUTANT C162S IN COMPLEX WITH CMPD2 [N-(4-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-3-(trifluoromethyl)benzamide]
Method: X-RAY DIFFRACTION / Resolution: 2.15 Å

PDB-6b8u:
Crystals Structure of B-Raf kinase domain in complex with an Imidazopyridinyl benzamide inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.68 Å

Chemicals

ChemComp-8EN:
~{N}-[3-(2-acetamidoimidazo[1,2-a]pyridin-6-yl)-4-methyl-phenyl]-3-(trifluoromethyl)benzamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / kinase / inhibitor / phosphotransferase / Transferase/Transferase Inhibitor / Proto-oncogene B-Raf / p94 / v-Raf murine sarcoma viral oncogene homolog B1 / ONCOPROTEIN / Transferase-Transferase Inhibitor complex

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