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TitleTwo classes of p38alpha MAP kinase inhibitors having a common diphenylether core but exhibiting divergent binding modes.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 15, Page 5274-5279, Year 2005
Publish dateJun 10, 2005 (structure data deposition date)
AuthorsMichelotti, E.L. / Moffett, K.K. / Nguyen, D. / Kelly, M.J. / Shetty, R. / Chai, X. / Northrop, K. / Namboodiri, V. / Campbell, B. / Flynn, G.A. ...Michelotti, E.L. / Moffett, K.K. / Nguyen, D. / Kelly, M.J. / Shetty, R. / Chai, X. / Northrop, K. / Namboodiri, V. / Campbell, B. / Flynn, G.A. / Fujimoto, T. / Hollinger, F.P. / Bukhtiyarova, M. / Springman, E.B. / Karpusas, M.
External linksBioorg. Med. Chem. Lett. / PubMed:16169718
MethodsX-ray diffraction
Resolution2 Å
Structure data

PDB-1zyj:
Human P38 MAP Kinase in Complex with Inhibitor 1a
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-1zz2:
Two Classes of p38alpha MAP Kinase Inhibitors Having a Common Diphenylether Core but Exhibiting Divergent Binding Modes
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-BOG:
octyl beta-D-glucopyranoside / detergent*YM

ChemComp-BI5:
4-PHENOXY-N-(PYRIDIN-2-YLMETHYL)BENZAMIDE

ChemComp-HOH:
WATER

ChemComp-B11:
N-[3-(4-FLUOROPHENOXY)PHENYL]-4-[(2-HYDROXYBENZYL)AMINO]PIPERIDINE-1-SULFONAMIDE

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / PROTEIN-INHIBITOR COMPLEX

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