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TitleBiphenyl Pyridazinone Derivatives as Inhaled PDE4 Inhibitors: Structural Biology and Structure-Activity Relationships.
Journal, issue, pagesJ. Med. Chem., Vol. 59, Page 10479-10497, Year 2016
Publish dateMay 18, 2016 (structure data deposition date)
AuthorsGracia, J. / Buil, M.A. / Castro, J. / Eichhorn, P. / Ferrer, M. / Gavalda, A. / Hernandez, B. / Segarra, V. / Lehner, M.D. / Moreno, I. ...Gracia, J. / Buil, M.A. / Castro, J. / Eichhorn, P. / Ferrer, M. / Gavalda, A. / Hernandez, B. / Segarra, V. / Lehner, M.D. / Moreno, I. / Pages, L. / Roberts, R.S. / Serrat, J. / Sevilla, S. / Taltavull, J. / Andres, M. / Cabedo, J. / Vilella, D. / Calama, E. / Carcasona, C. / Miralpeix, M.
External linksJ. Med. Chem. / PubMed:27933955
MethodsX-ray diffraction
Resolution2.61 Å
Structure data

PDB-5k1i:
PDE4 crystal structure in complex with small molecule inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.61 Å

Chemicals

ChemComp-6PT:
4-[(5-acetyl-2-ethyl-3-oxo-6-phenyl-2,3-dihydropyridazin-4-yl)amino]benzoic acid

ChemComp-ZN:
Unknown entry

ChemComp-MG:
Unknown entry

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE / phosphodiesterases / inhibitor

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