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Structure paper

TitlePyridopyrimidinone Derivatives as Potent and Selective c-Jun N-Terminal Kinase (JNK) Inhibitors.
Journal, issue, pagesAcs Med. Chem. Lett., Vol. 6, Page 413-418, Year 2015
Publish dateFeb 10, 2015 (structure data deposition date)
AuthorsZheng, K. / Park, C.M. / Iqbal, S. / Hernandez, P. / Park, H. / LoGrasso, P.V. / Feng, Y.
External linksAcs Med. Chem. Lett. / PubMed:25893042
MethodsX-ray diffraction
Resolution2.04 - 2.055 Å
Structure data

PDB-4y46:
Pyridopyrimidinone Derivatives as Potent and Selective c-Jun N-Terminal Kinase (JNK) inhibitors
Method: X-RAY DIFFRACTION / Resolution: 2.04 Å

PDB-4y5h:
Pyridopyrimidinone Derivatives as Potent and Selective c-Jun N-Terminal Kinase (JNK) inhibitors
Method: X-RAY DIFFRACTION / Resolution: 2.055 Å

Chemicals

ChemComp-4F2:
1-{trans-4-[(8-cyclopentyl-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl)amino]cyclohexyl}-3-propan-2-ylurea

ChemComp-HOH:
WATER

ChemComp-519:
1-(trans-4-{[7-oxo-8-(propan-2-yl)-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl]amino}cyclohexyl)-3-propan-2-ylurea

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / JNK / MAP kinase / TRANSFERASE-TRANSFERASE INHIBITOR complex

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