8UJY
Crystal structure of human WD repeat-containing protein 5 in complex with 4-(3,5-dimethoxybenzyl)-9-(4-fluoro-2-methylphenyl)-7-((2-imino-3-methyl-2,3-dihydro-1H-imidazol-1-yl)methyl)-3,4-dihydrobenzo[f][1,4]oxazepin-5(2H)-one (compound 8)
8UJY の概要
エントリーDOI | 10.2210/pdb8ujy/pdb |
分子名称 | WD repeat-containing protein 5, (9P)-4-[(3,5-dimethoxyphenyl)methyl]-9-(4-fluoro-2-methylphenyl)-7-{[(2E)-2-imino-3-methyl-2,3-dihydro-1H-imidazol-1-yl]methyl}-3,4-dihydro-1,4-benzoxazepin-5(2H)-one (3 entities in total) |
機能のキーワード | wdr5, cancer, drug discovery, transcription |
由来する生物種 | Homo sapiens (human) |
タンパク質・核酸の鎖数 | 2 |
化学式量合計 | 69640.95 |
構造登録者 | |
主引用文献 | Teuscher, K.B.,Mills, J.J.,Tian, J.,Han, C.,Meyers, K.M.,Sai, J.,South, T.M.,Crow, M.M.,Van Meveren, M.,Sensintaffar, J.L.,Zhao, B.,Amporndanai, K.,Moore, W.J.,Stott, G.M.,Tansey, W.P.,Lee, T.,Fesik, S.W. Structure-Based Discovery of Potent, Orally Bioavailable Benzoxazepinone-Based WD Repeat Domain 5 Inhibitors. J.Med.Chem., 66:16783-16806, 2023 Cited by PubMed: 38085679DOI: 10.1021/acs.jmedchem.3c01529 主引用文献が同じPDBエントリー |
実験手法 | X-RAY DIFFRACTION (2.01 Å) |
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