Database of articles cited by EMDB/PDB/SASBDB data

Keywords
Structure methods	All X-ray diffraction NMR electron microscopy small angle scattering neutron diffraction fiber diffraction powder diffraction infrared spectroscopy EPR fluorescence transfer theoretical model Hybrid
Author
Journal
IF	>30 >20 >10 >5 all

Title	Identification of allosteric binding sites for PI3K alpha oncogenic mutant specific inhibitor design.
Journal, issue, pages	Bioorg. Med. Chem., Vol. 25, Page 1481-1486, Year 2017
Publish date	Aug 8, 2016 (structure data deposition date)
Authors	Miller, M.S. / Maheshwari, S. / McRobb, F.M. / Kinzler, K.W. / Amzel, L.M. / Vogelstein, B. / Gabelli, S.B.
External links	Bioorg. Med. Chem. / PubMed:28129991
Methods	X-ray diffraction
Resolution	3.11 - 3.55 Å
Structure data	PDB-5sw8: Crystal structure of PI3Kalpha in complex with fragments 7 and 11 Method: X-RAY DIFFRACTION / Resolution: 3.3 Å PDB-5swg: Crystal Structure of PI3Kalpha in complex with fragments 5 and 21 Method: X-RAY DIFFRACTION / Resolution: 3.11 Å PDB-5swo: Crystal Structure of PI3Kalpha in complex with fragments 4 and 19 Method: X-RAY DIFFRACTION / Resolution: 3.5 Å PDB-5swp: Crystal Structure of PI3Kalpha in complex with fragments 6 and 24 Method: X-RAY DIFFRACTION / Resolution: 3.41 Å PDB-5swr: Crystal Structure of PI3Kalpha in complex with fragments 20 and 26 Method: X-RAY DIFFRACTION / Resolution: 3.31 Å PDB-5swt: Crystal Structure of PI3Kalpha in complex with fragments 17 and 27 Method: X-RAY DIFFRACTION / Resolution: 3.49 Å PDB-5sx8: Crystal Structure of PI3Kalpha in complex with fragments 12 and 15 Method: X-RAY DIFFRACTION / Resolution: 3.47 Å PDB-5sx9: Crystal Structure of PI3Kalpha in complex with fragment 14 Method: X-RAY DIFFRACTION / Resolution: 3.52 Å PDB-5sxa: Crystal Structure of PI3Kalpha in complex with fragment 10 Method: X-RAY DIFFRACTION / Resolution: 3.35 Å PDB-5sxb: Crystal Structure of PI3Kalpha in complex with fragment 23 Method: X-RAY DIFFRACTION / Resolution: 3.3 Å PDB-5sxc: Crystal Structure of PI3Kalpha in complex with fragment 8 Method: X-RAY DIFFRACTION / Resolution: 3.55 Å PDB-5sxd: Crystal Structure of PI3Kalpha in complex with fragment 22 Method: X-RAY DIFFRACTION / Resolution: 3.5 Å PDB-5sxe: Crystal Structure of PI3Kalpha in complex with fragments 19 and 28 Method: X-RAY DIFFRACTION / Resolution: 3.51 Å PDB-5sxf: Crystal Structure of PI3Kalpha in complex with fragment 9 Method: X-RAY DIFFRACTION / Resolution: 3.46 Å PDB-5sxi: Crystal Structure of PI3Kalpha in complex with fragment 13 Method: X-RAY DIFFRACTION / Resolution: 3.4 Å PDB-5sxj: Crystal Structure of PI3Kalpha in complex with fragment 29 Method: X-RAY DIFFRACTION / Resolution: 3.42 Å PDB-5sxk: Crystal Structure of PI3Kalpha in complex with fragment 18 Method: X-RAY DIFFRACTION / Resolution: 3.55 Å
Chemicals	ChemComp-EPE: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID / pH bufferYM / HEPES ChemComp-70S: 2H-indazol-5-amine ChemComp-FB1: 2-CHLOROBENZENESULFONAMIDE ChemComp-AX7: 1H-benzimidazol-2-amine ChemComp-CAQ: CATECHOL / Catechol ChemComp-CL: Unknown entry / Chloride ChemComp-70T: 2-methyl-5-nitro-1H-indole ChemComp-2ZV: 4-methyl-3-nitropyridin-2-amine ChemComp-70W: tert-butyl 4-aminopiperidine-1-carboxylate ChemComp-70V: 2-methylcyclohexane-1,3-dione ChemComp-718: 6-hydroxy-3,4-dihydronaphthalen-1(2H)-one ChemComp-SAL: 2-HYDROXYBENZOIC ACID / Salicylic acid ChemComp-71A: pyridin-3-ol / 2-Pyridone ChemComp-71B: 3-fluoro-4-methoxyaniline ChemComp-71M: 6-methylpyridin-2-amine ChemComp-LUZ: pteridine-2,4(1H,3H)-dione ChemComp-71L: 4,6-dimethylpyridin-2-amine ChemComp-71N: 2-(trifluoromethyl)-1H-benzimidazol-5-amine ChemComp-SOA: ISATOIC ANHYDRIDE / Isatoic anhydride ChemComp-URF: 5-FLUOROURACIL / medication, chemotherapyYM / Fluorouracil ChemComp-71F: 2-methoxybenzoic acid / Anisic acid ChemComp-71G: 3-aminobenzonitrile ChemComp-ES3: 4-bromo-1H-imidazole ChemComp-HPP: HYDROXYPHENYL PROPIONIC ACID / Phloretic acid ChemComp-71J: trans-cyclohexane-1,4-diol ChemComp-BHO: BENZHYDROXAMIC ACID ChemComp-71K: 2-methylbenzene-1,3-diamine
Source	homo sapiens (human)
Keywords	TRANSFERASE/TRANSFERASE INHIBITOR / lipid kinase / phosphoinositide / 3-kinase / signaling / TRANSFERASE-TRANSFERASE INHIBITOR complex / TRANSFERASE