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TitlePhospshoinositide 3-Kinase (PI3K)/Mammalian Target of Rapamycin (mTOR) Dual Inhibitors: Discovery and Structure-Activity Relationships of a Series of Quinoline and Quinoxaline Derivatives.
Journal, issue, pagesJ. Med. Chem., Vol. 54, Page 4735-4751, Year 2011
Publish dateMay 16, 2011 (structure data deposition date)
AuthorsNishimura, N. / Siegmund, A. / Liu, L. / Yang, K. / Bryan, M.C. / Andrews, K.L. / Bo, Y. / Booker, S.K. / Caenepeel, S. / Freeman, D. ...Nishimura, N. / Siegmund, A. / Liu, L. / Yang, K. / Bryan, M.C. / Andrews, K.L. / Bo, Y. / Booker, S.K. / Caenepeel, S. / Freeman, D. / Liao, H. / McCarter, J. / Mullady, E.L. / San Miguel, T. / Subramanian, R. / Tamayo, N. / Wang, L. / Whittington, D.A. / Zalameda, L. / Zhang, N. / Hughes, P.E. / Norman, M.H.
External linksJ. Med. Chem. / PubMed:21612232
MethodsX-ray diffraction
Resolution2.55 Å
Structure data

PDB-3s2a:
Crystal structure of PI3K-gamma in complex with a quinoline inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.55 Å

Chemicals

ChemComp-SO4:
SULFATE ION

ChemComp-2NQ:
N-{2-chloro-5-[4-(morpholin-4-yl)quinolin-6-yl]pyridin-3-yl}-4-fluorobenzenesulfonamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / p110-gamma / kinase / phosphotransfer / p101 / p84 / leukocytes / TRANSFERASE-TRANSFERASE INHIBITOR complex

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