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TitleDiscovery of Small Molecule RIP1 Kinase Inhibitors for the Treatment of Pathologies Associated with Necroptosis.
Journal, issue, pagesACS Med Chem Lett, Vol. 4, Page 1238-1243, Year 2013
Publish dateOct 30, 2013 (structure data deposition date)
AuthorsHarris, P.A. / Bandyopadhyay, D. / Berger, S.B. / Campobasso, N. / Capriotti, C.A. / Cox, J.A. / Dare, L. / Finger, J.N. / Hoffman, S.J. / Kahler, K.M. ...Harris, P.A. / Bandyopadhyay, D. / Berger, S.B. / Campobasso, N. / Capriotti, C.A. / Cox, J.A. / Dare, L. / Finger, J.N. / Hoffman, S.J. / Kahler, K.M. / Lehr, R. / Lich, J.D. / Nagilla, R. / Nolte, R.T. / Ouellette, M.T. / Pao, C.S. / Schaeffer, M.C. / Smallwood, A. / Sun, H.H. / Swift, B.A. / Totoritis, R.D. / Ward, P. / Marquis, R.W. / Bertin, J. / Gough, P.J.
External linksACS Med Chem Lett / PubMed:24900635
MethodsX-ray diffraction
Resolution2.57 Å
Structure data

PDB-4neu:
X-ray structure of Receptor Interacting Protein 1 (RIP1)kinase domain with a 1-aminoisoquinoline inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.57 Å

Chemicals

ChemComp-MG:
Unknown entry

ChemComp-Q1A:
1-[4-(1-aminoisoquinolin-5-yl)phenyl]-3-(5-tert-butyl-1,2-oxazol-3-yl)urea

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / Kinase / ATP binding / Phosphorylation

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