タイトル | Halogen-Enriched Fragment Libraries as Leads for Drug Rescue of Mutant P53. |
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ジャーナル・号・ページ | J. Am. Chem. Soc., Vol. 134, Page 6810-, Year 2012 |
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掲載日 | 2012年1月30日 (構造データの登録日) |
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著者 | Wilcken, R. / Liu, X. / Zimmermann, M.O. / Rutherford, T.J. / Fersht, A.R. / Joerger, A.C. / Boeckler, F.M. |
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リンク | J. Am. Chem. Soc. / PubMed:22439615 |
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手法 | X線回折 |
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解像度 | 1.42 - 1.7 Å |
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構造データ | PDB-4agl: Structure of the p53 core domain mutant Y220C bound to the stabilizing small molecule PhiKan784 手法: X-RAY DIFFRACTION / 解像度: 1.7 Å PDB-4agm: Structure of the p53 core domain mutant Y220C bound to the stabilizing small molecule PhiKan5086 手法: X-RAY DIFFRACTION / 解像度: 1.52 Å PDB-4agn: Structure of the p53 core domain mutant Y220C bound to the stabilizing small molecule PhiKan5116 手法: X-RAY DIFFRACTION / 解像度: 1.6 Å PDB-4ago: Structure of the p53 core domain mutant Y220C bound to the stabilizing small molecule PhiKan5174 手法: X-RAY DIFFRACTION / 解像度: 1.45 Å PDB-4agp: Structure of the p53 core domain mutant Y220C bound to the stabilizing small molecule PhiKan5176 手法: X-RAY DIFFRACTION / 解像度: 1.5 Å PDB-4agq: Structure of the p53 core domain mutant Y220C bound to the stabilizing small molecule PhiKan5196 手法: X-RAY DIFFRACTION / 解像度: 1.42 Å |
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化合物 | ChemComp-P84: 2,4-BIS(IODANYL)-6-[[METHYL-(1-METHYLPIPERIDIN-4-YL)AMINO]METHYL]PHENOL
ChemComp-P86: 2-{[4-(DIETHYLAMINO)PIPERIDIN-1-YL]METHYL}-4,6-DIIODOPHENOL
ChemComp-NXG: 2-{[4-(DIETHYLAMINO)PIPERIDIN-1-YL]METHYL}-4-(3-HYDROXYPROP-1-YN-1-YL)-6-IODOPHENOL
ChemComp-P74: TERT-BUTYL [3-(3-{[4-(DIETHYLAMINO)PIPERIDIN-1-YL]METHYL}-4-HYDROXY-5-IODOPHENYL)PROP-2-YN-1-YL]CARBAMATE
ChemComp-P51: 2-{[4-(diethylamino)piperidin-1-yl]methyl}-6-iodo-4-(3-phenoxyprop-1-yn-1-yl)phenol
ChemComp-P96: 2-{[4-(diethylamino)piperidin-1-yl]methyl}-6-iodo-4-[3-(phenylamino)prop-1-yn-1-yl]phenol
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由来 | - homo sapiens (ヒト)
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キーワード | CELL CYCLE / TRANSCRIPTION / APOPTOSIS / CANCER MUTATION / SURFACE CREVICE / PROTEIN FOLDING / AGGREGATION / MUTANT RESCUE / SMALL-MOLECULE DRUG / PROTEIN STABILIZATION / HALOGEN BONDING / ZINC BINDING / ACETYLENE LINKER |
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