6O2Z
Crystal structure of IDH1 R132H mutant in complex with compound 32
6O2Z の概要
エントリーDOI | 10.2210/pdb6o2z/pdb |
分子名称 | Isocitrate dehydrogenase [NADP] cytoplasmic, 6-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3-yl)methyl]amino}-2-methylpyridine-3-carbonitrile, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... (5 entities in total) |
機能のキーワード | idh1, allosteric inhibitor, oxidoreductase, inhibitor complex, oxidoreductase-inhibitor complex, oxidoreductase/inhibitor |
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 | 98591.89 |
構造登録者 | |
主引用文献 | Lin, J.,Lu, W.,Caravella, J.A.,Campbell, A.M.,Diebold, R.B.,Ericsson, A.,Fritzen, E.,Gustafson, G.R.,Lancia Jr., D.R.,Shelekhin, T.,Wang, Z.,Castro, J.,Clarke, A.,Gotur, D.,Josephine, H.R.,Katz, M.,Diep, H.,Kershaw, M.,Yao, L.,Kauffman, G.,Hubbs, S.E.,Luke, G.P.,Toms, A.V.,Wang, L.,Bair, K.W.,Barr, K.J.,Dinsmore, C.,Walker, D.,Ashwell, S. Discovery and Optimization of Quinolinone Derivatives as Potent, Selective, and Orally Bioavailable Mutant Isocitrate Dehydrogenase 1 (mIDH1) Inhibitors. J.Med.Chem., 62:6575-6596, 2019 Cited by PubMed: 31199148DOI: 10.1021/acs.jmedchem.9b00362 主引用文献が同じPDBエントリー |
実験手法 | X-RAY DIFFRACTION (2.5 Å) |
構造検証レポート
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