タイトル | Identification and Characterization of JAK2 Pseudokinase Domain Small Molecule Binders. |
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ジャーナル・号・ページ | ACS Med Chem Lett, Vol. 8, Page 618-621, Year 2017 |
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掲載日 | 2017年2月14日 (構造データの登録日) |
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著者 | Puleo, D.E. / Kucera, K. / Hammaren, H.M. / Ungureanu, D. / Newton, A.S. / Silvennoinen, O. / Jorgensen, W.L. / Schlessinger, J. |
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リンク | ACS Med Chem Lett / PubMed:28626521 |
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手法 | X線回折 |
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解像度 | 1.501 - 2.103 Å |
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構造データ | PDB-5usy: JAK2 JH1 in complex with JNJ-7706621 手法: X-RAY DIFFRACTION / 解像度: 2 Å PDB-5usz: JAK2 JH2 in complex with JNJ-7706621 手法: X-RAY DIFFRACTION / 解像度: 2.103 Å PDB-5ut0: JAK2 JH2 in complex with AT9283 手法: X-RAY DIFFRACTION / 解像度: 2.102 Å PDB-5ut1: JAK2 JH2 in complex with BI-D1870 手法: X-RAY DIFFRACTION / 解像度: 1.95 Å PDB-5ut2: JAK2 JH2 in complex with PRT062607 手法: X-RAY DIFFRACTION / 解像度: 1.75 Å PDB-5ut3: JAK2 JH2 in complex with IKK-2 Inhibitor VI 手法: X-RAY DIFFRACTION / 解像度: 1.501 Å |
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化合物 | ChemComp-SKE: 4-({5-amino-1-[(2,6-difluorophenyl)carbonyl]-1H-1,2,4-triazol-3-yl}amino)benzenesulfonamide / JNJ-7706621
ChemComp-35R: 1-cyclopropyl-3-{3-[5-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl}urea / AT-9283
ChemComp-7DZ: (7S)-2-[(3,5-difluoro-4-hydroxyphenyl)amino]-5,7-dimethyl-8-(3-methylbutyl)-7,8-dihydropteridin-6(5H)-one
ChemComp-3YT: 2-{[(1R,2S)-2-aminocyclohexyl]amino}-4-{[3-(2H-1,2,3-triazol-2-yl)phenyl]amino}pyrimidine-5-carboxamide / PRT-062607
ChemComp-IK1: 5-PHENYL-2-UREIDOTHIOPHENE-3-CARBOXAMIDE
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由来 | homo sapiens (ヒト)
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キーワード | TRANSFERASE/TRANSFERASE INHIBITOR / Kinase Domain / TRANSFERASE-TRANSFERASE INHIBITOR complex / Pseudokinase Domain |
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