タイトル | Structural basis of Wee family kinase inhibition by small molecules |
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ジャーナル・号・ページ | to be published |
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掲載日 | 2017年4月1日 (構造データの登録日) |
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著者 | Zhu, J.-Y. / Schonbrunn, E. |
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リンク | PubMedで検索 |
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手法 | X線回折 |
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解像度 | 1.85 - 2.1 Å |
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構造データ | PDB-5vd4: CRYSTAL STRUCTURE OF HUMAN WEE1 KINASE DOMAIN IN COMPLEX WITH RAC-IV-016, a MK1775 analougue 手法: X-RAY DIFFRACTION / 解像度: 2.02 Å PDB-5vd5: CRYSTAL STRUCTURE OF HUMAN WEE1 KINASE DOMAIN IN COMPLEX WITH RAC-IV-050, a MK1775 analougue 手法: X-RAY DIFFRACTION / 解像度: 2.05 Å PDB-5vd7: CRYSTAL STRUCTURE OF HUMAN WEE1 KINASE DOMAIN IN COMPLEX WITH RAC-IV-098, a MK1775 analogue 手法: X-RAY DIFFRACTION / 解像度: 2.08 Å PDB-5vd8: Crystal structure of human WEE1 kinase domain in complex with RAC-IV-099, a MK1775 analogue 手法: X-RAY DIFFRACTION / 解像度: 1.85 Å PDB-5vd9: Crystal structure of human WEE1 kinase domain in complex with RAC-IV-097, a MK1775 analogue 手法: X-RAY DIFFRACTION / 解像度: 1.87 Å PDB-5vda: Crystal structure of human WEE1 kinase domain in complex with RAC-IV-101, a MK1775 analogue 手法: X-RAY DIFFRACTION / 解像度: 2.1 Å |
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化合物 | ChemComp-99J: 6-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-2-(prop-2-en-1-yl)-1-{6-[(1S)-2,2,2-trifluoro-1-hydroxyethyl]pyridin-2-yl}-1,2-dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one
ChemComp-99M: 1-[6-(2-hydroxypropan-2-yl)pyridin-2-yl]-6-{[4-(morpholin-4-yl)phenyl]amino}-2-(prop-2-en-1-yl)-1,2-dihydro-3H-pyrazolo
ChemComp-99V: 6-{[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]amino}-1-[6-(2-hydroxypropan-2-yl)pyridin-2-yl]-2-(prop-2-en-1-yl)-1,2-dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one
ChemComp-98M: 6-{[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]amino}-1-[6-(2-hydroxypropan-2-yl)pyridin-2-yl]-2-(prop-2-en-1-yl)-1,2-dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one
ChemComp-98G: 1-{6-[(1R)-1-hydroxyethyl]pyridin-2-yl}-6-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-2-(prop-2-en-1-yl)-1,2-dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one
ChemComp-98D: 1-{6-[(1S)-1-hydroxyethyl]pyridin-2-yl}-6-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-2-(prop-2-en-1-yl)-1,2-dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one
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由来 | - homo sapiens (ヒト)
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キーワード | TRANSFERASE/TRANSFERASE INHIBITOR / KINASE DOMAIN / CELL CYCLE / WEE1 / TRANSFERASE / INHIBITOR / TRANSFERASE-TRANSFERASE INHIBITOR complex |
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