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	Structure-Guided Discovery of Potent and Selective Inhibitors of ERK1/2 from a Modestly Active and Promiscuous Chemical Start Point.
ジャーナル・号・ページ	J. Med. Chem., Vol. 60, Page 3438-3450, Year 2017
掲載日	2017年3月20日 (構造データの登録日)
著者	Ward, R.A. / Bethel, P. / Cook, C. / Davies, E. / Debreczeni, J.E. / Fairley, G. / Feron, L. / Flemington, V. / Graham, M.A. / Greenwood, R. ...Ward, R.A. / Bethel, P. / Cook, C. / Davies, E. / Debreczeni, J.E. / Fairley, G. / Feron, L. / Flemington, V. / Graham, M.A. / Greenwood, R. / Griffin, N. / Hanson, L. / Hopcroft, P. / Howard, T.D. / Hudson, J. / James, M. / Jones, C.D. / Jones, C.R. / Lamont, S. / Lewis, R. / Lindsay, N. / Roberts, K. / Simpson, I. / St-Gallay, S. / Swallow, S. / Tang, J. / Tonge, M. / Wang, Z. / Zhai, B.
リンク	J. Med. Chem. / PubMed:28376306
手法	X線回折
解像度	1.94 - 2.74 Å
構造データ	PDB-5ngu: Human Erk2 with an Erk1/2 inhibitor 手法: X-RAY DIFFRACTION / 解像度: 2.74 Å PDB-5nhf: Human Erk2 with an Erk1/2 inhibitor 手法: X-RAY DIFFRACTION / 解像度: 2.14 Å PDB-5nhh: Human Erk2 with an Erk1/2 inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.94 Å PDB-5nhj: Human Erk2 with an Erk1/2 inhibitor 手法: X-RAY DIFFRACTION / 解像度: 2.12 Å PDB-5nhl: Human Erk2 with an Erk1/2 inhibitor 手法: X-RAY DIFFRACTION / 解像度: 2.07 Å PDB-5nho: Human Erk2 with an Erk1/2 inhibitor 手法: X-RAY DIFFRACTION / 解像度: 2.24 Å PDB-5nhp: Human Erk2 with an Erk1/2 inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.99 Å PDB-5nhv: Human Erk2 with an Erk1/2 inhibitor 手法: X-RAY DIFFRACTION / 解像度: 2 Å
化合物	ChemComp-SO4: SULFATE ION / 硫酸ジアニオン ChemComp-8X2: 2-[2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]pyrimidin-4-yl]-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one ChemComp-HOH: WATER ChemComp-8X5: 2-[2-(oxan-4-ylamino)pyrimidin-4-yl]-5-(phenylmethyl)-6,7-dihydro-1~{H}-pyrrolo[3,2-c]pyridin-4-one ChemComp-8XH: 5-(2-methoxyethyl)-2-[2-(oxan-4-ylamino)pyrimidin-4-yl]-6,7-dihydro-1~{H}-pyrrolo[3,2-c]pyridin-4-one ChemComp-8XE: 5-(2-methoxyethyl)-2-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-6,7-dihydro-1~{H}-pyrrolo[3,2-c]pyridin-4-one ChemComp-8XB: (6~{R})-5-(2-methoxyethyl)-6-methyl-2-[5-methyl-2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-6,7-dihydro-1~{H}-pyrrolo[3,2-c]pyridin-4-one ChemComp-8XN: (6~{S})-5-(2-methoxyethyl)-6-methyl-2-[5-methyl-2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-6,7-dihydro-1~{H}-pyrrolo[3,2-c]pyridin-4-one ChemComp-8XK: 5-(2-methoxyethyl)-1-methyl-2-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-6,7-dihydropyrrolo[3,2-c]pyridin-4-one ChemComp-8QB: 7-[2-(oxan-4-ylamino)pyrimidin-4-yl]-3,4-dihydro-2~{H}-pyrrolo[1,2-a]pyrazin-1-one
由来	homo sapiens (ヒト)
キーワード	TRANSFERASE / Erk2 / kinase / inhibitor / oncology