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Structure paper

TitleDesign and synthesis of potent, orally bioavailable dihydroquinazolinone inhibitors of p38 MAP kinase.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 13, Page 277-280, Year 2003
Publish dateJul 22, 2002 (structure data deposition date)
AuthorsStelmach, J.E. / Liu, L. / Patel, S.B. / Pivnichny, J.V. / Scapin, G. / Singh, S. / Hop, C.E. / Wang, Z. / Strauss, J.R. / Cameron, P.M. ...Stelmach, J.E. / Liu, L. / Patel, S.B. / Pivnichny, J.V. / Scapin, G. / Singh, S. / Hop, C.E. / Wang, Z. / Strauss, J.R. / Cameron, P.M. / Nichols, E.A. / O'Keefe, S.J. / O'Neill, E.A. / Schmatz, D.M. / Schwartz, C.D. / Thompson, C.M. / Zaller, D.M. / Doherty, J.B.
External linksBioorg. Med. Chem. Lett. / PubMed:12482439
MethodsX-ray diffraction
Resolution2.4 Å
Structure data

PDB-1m7q:
Crystal structure of p38 MAP kinase in complex with a dihydroquinazolinone inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

Chemicals

ChemComp-SO4:
SULFATE ION

ChemComp-DQO:
1-(2,6-DICHLOROPHENYL)-5-(2,4-DIFLUOROPHENYL)-7-PIPERAZIN-1-YL-3,4-DIHYDROQUINAZOLIN-2(1H)-ONE

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / serine/threonine kinase / ATP-binding domain / inhibitor

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