EMDB/PDB/SASBDBから引用されている文献のデータベース

キーワード
構造解析手法	All X線回折 NMR 電子顕微鏡小角散乱中性子線回折線維回折粉末回折赤外分光 EPR FRET 理論モデルハイブリッド
著者・登録者
ジャーナル
IF	>30 >20 >10 >5 all

タイトル	Optimization of the Lead Compound NVP-BHG712 as a Colorectal Cancer Inhibitor.
ジャーナル・号・ページ	Chemistry, Vol. 29, Page e202203967-e202203967, Year 2023
掲載日	2022年11月10日 (構造データの登録日)
著者	Troster, A. / DiPrima, M. / Jores, N. / Kudlinzki, D. / Sreeramulu, S. / Gande, S.L. / Linhard, V. / Ludig, D. / Schug, A. / Saxena, K. ...Troster, A. / DiPrima, M. / Jores, N. / Kudlinzki, D. / Sreeramulu, S. / Gande, S.L. / Linhard, V. / Ludig, D. / Schug, A. / Saxena, K. / Reinecke, M. / Heinzlmeir, S. / Leisegang, M.S. / Wollenhaupt, J. / Lennartz, F. / Weiss, M.S. / Kuster, B. / Tosato, G. / Schwalbe, H.
リンク	Chemistry / PubMed:36799129
手法	X線回折
解像度	1.12 - 2.02 Å
構造データ	PDB-8bm8: Crystal Structure of Ephrin A2 (EphA2) Receptor Protein Kinase with Compound 11 手法: X-RAY DIFFRACTION / 解像度: 1.68 Å PDB-8boc: Crystal Structure of Ephrin A2 (EphA2) Receptor Protein Kinase with Compound 19 手法: X-RAY DIFFRACTION / 解像度: 1.9 Å PDB-8bod: Crystal Structure of Ephrin A2 (EphA2) Receptor Protein Kinase with Compound 20 手法: X-RAY DIFFRACTION / 解像度: 1.5 Å PDB-8bof: Crystal Structure of Ephrin A2 (EphA2) Receptor Protein Kinase with Compound 12 手法: X-RAY DIFFRACTION / 解像度: 1.82 Å PDB-8bog: Crystal Structure of Ephrin A2 (EphA2) Receptor Protein Kinase with Compound 7 手法: X-RAY DIFFRACTION / 解像度: 1.47 Å PDB-8boh: Crystal Structure of Ephrin A2 (EphA2) Receptor Protein Kinase with Compound 8 手法: X-RAY DIFFRACTION / 解像度: 1.42 Å PDB-8boi: Crystal Structure of Ephrin A2 (EphA2) Receptor Protein Kinase with Compound 9 手法: X-RAY DIFFRACTION / 解像度: 1.63 Å PDB-8bok: Crystal Structure of Ephrin A2 (EphA2) Receptor Protein Kinase with Compound 11 手法: X-RAY DIFFRACTION / 解像度: 2.02 Å PDB-8bom: Crystal Structure of Ephrin A2 (EphA2) Receptor Protein Kinase with Compound 14 手法: X-RAY DIFFRACTION / 解像度: 1.12 Å
化合物	化合物画像なし ChemComp-QT1: Unknown entry ChemComp-HOH: WATER ChemComp-QUF: ~{N}-[3,5-bis(trifluoromethyl)phenyl]-4-methyl-3-[(1-methyl-6-pyridin-3-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide ChemComp-QTX: ~{N}-[3,5-bis(chloranyl)phenyl]-4-methyl-3-[(1-methyl-6-pyridin-3-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide ChemComp-R3L: 4-methyl-~{N}-(3-methylphenyl)-3-[(1-methyl-6-pyridin-3-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide ChemComp-QUU: ~{N}-[4-methyl-3-[(1-methyl-6-pyridin-3-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]phenyl]-3-(trifluoromethyl)benzamide ChemComp-R0T: 4-methyl-~{N}-[3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[(1-methyl-6-pyridin-3-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide ChemComp-R0O: 4-methyl-~{N}-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-[(1-methyl-6-pyridin-3-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide ChemComp-R0X: ~{N}-(3,5-dimethoxyphenyl)-4-methyl-3-[(1-methyl-6-pyridin-3-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide ChemComp-QU6: ~{N}-(3-methoxyphenyl)-4-methyl-3-[(1-methyl-6-pyridin-3-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide
由来	homo sapiens (ヒト)
キーワード	TRANSFERASE / Inhibitor / Complex / Protein Tyrosine Kinase / Protein Tyropsine Kinase