タイトル | Discovery of Cofactor Competitive Inhibitors against the Human Methyltransferase Fibrillarin. |
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ジャーナル・号・ページ | Pharmaceuticals, Vol. 15, Year 2021 |
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掲載日 | 2021年9月30日 (構造データの登録日) |
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著者 | Shi, Y. / El-Deeb, I.M. / Masic, V. / Hartley-Tassell, L. / Maggioni, A. / Itzstein, M.V. / Ve, T. |
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リンク | Pharmaceuticals / PubMed:35056083 |
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手法 | X線回折 |
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解像度 | 1.75 - 1.99 Å |
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構造データ | PDB-7se6: Crystal structure of human Fibrillarin in ligand-free state 手法: X-RAY DIFFRACTION / 解像度: 1.99 Å PDB-7se7: Crystal structure of human Fibrillarin in complex with S-adenosyl-L-methionine 手法: X-RAY DIFFRACTION / 解像度: 1.75 Å PDB-7se8: Crystal structure of human Fibrillarin in complex with fragment 1 from cocktail soak 手法: X-RAY DIFFRACTION / 解像度: 1.75 Å PDB-7se9: Crystal structure of human Fibrillarin in complex with compound 1 from single soak 手法: X-RAY DIFFRACTION / 解像度: 1.75 Å PDB-7sea: Crystal structure of human Fibrillarin in complex with compound 2 from cocktail soak 手法: X-RAY DIFFRACTION / 解像度: 1.91 Å PDB-7seb: Crystal structure of human Fibrillarin in complex with compound 2 from single soak 手法: X-RAY DIFFRACTION / 解像度: 1.81 Å PDB-7sec: Crystal structure of human Fibrillarin in complex with compound 1a 手法: X-RAY DIFFRACTION / 解像度: 1.9 Å PDB-7sed: Crystal structure of human Fibrillarin in complex with compound 2a 手法: X-RAY DIFFRACTION / 解像度: 1.9 Å |
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化合物 | ChemComp-8W1: (5S)-3-methyl-7-(trifluoromethyl)pyrrolo[1,2-a]pyrazin-1(2H)-one
ChemComp-8WP: 2-[(8S)-4-oxo-2-(trifluoromethyl)-4,5-dihydropyrazolo[1,5-a]pyrazin-6-yl]acetamide
ChemComp-8VD: N-(piperidin-4-yl)-6-(trifluoromethyl)pyrimidin-4-amine
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由来 | homo sapiens (ヒト)
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キーワード | TRANSFERASE / Methyltransferase / S-adenosyl methionine |
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