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	AchievingIn VivoTarget Depletion through the Discovery and Optimization of Benzimidazolone BCL6 Degraders.
ジャーナル・号・ページ	J. Med. Chem., Vol. 63, Page 4047-4068, Year 2020
掲載日	2019年12月11日 (構造データの登録日)
著者	Bellenie, B.R. / Cheung, K.J. / Varela, A. / Pierrat, O.A. / Collie, G.W. / Box, G.M. / Bright, M.D. / Gowan, S. / Hayes, A. / Rodrigues, M.J. ...Bellenie, B.R. / Cheung, K.J. / Varela, A. / Pierrat, O.A. / Collie, G.W. / Box, G.M. / Bright, M.D. / Gowan, S. / Hayes, A. / Rodrigues, M.J. / Shetty, K.N. / Carter, M. / Davis, O.A. / Henley, A.T. / Innocenti, P. / Johnson, L.D. / Liu, M. / de Klerk, S. / Le Bihan, Y.V. / Lloyd, M.G. / McAndrew, P.C. / Shehu, E. / Talbot, R. / Woodward, H.L. / Burke, R. / Kirkin, V. / van Montfort, R.L.M. / Raynaud, F.I. / Rossanese, O.W. / Hoelder, S.
リンク	J. Med. Chem. / PubMed:32275432
手法	X線回折
解像度	1.43 - 2.36 Å
構造データ	PDB-6tof: Crystal structure of human BCL6 BTB domain in complex with compound 4 手法: X-RAY DIFFRACTION / 解像度: 1.67 Å PDB-6tog: Crystal structure of human BCL6 BTB domain in complex with compound 5 手法: X-RAY DIFFRACTION / 解像度: 1.69 Å PDB-6toh: Crystal structure of human BCL6 BTB domain in complex with compound 6 手法: X-RAY DIFFRACTION / 解像度: 1.58 Å PDB-6toi: Crystal structure of human BCL6 BTB domain in complex with compound 11f 手法: X-RAY DIFFRACTION / 解像度: 1.58 Å PDB-6toj: Crystal structure of human BCL6 BTB domain in complex with compound 17a 手法: X-RAY DIFFRACTION / 解像度: 1.85 Å PDB-6tok: Crystal structure of human BCL6 BTB domain in complex with compound 23d 手法: X-RAY DIFFRACTION / 解像度: 1.43 Å PDB-6tol: Crystal structure of human BCL6 BTB domain in complex with compound 25a 手法: X-RAY DIFFRACTION / 解像度: 1.64 Å PDB-6tom: Crystal structure of human BCL6 BTB domain in complex with compound 1 手法: X-RAY DIFFRACTION / 解像度: 1.9 Å PDB-6ton: Crystal structure of human BCL6 BTB domain in complex with compound 25b 手法: X-RAY DIFFRACTION / 解像度: 2.36 Å PDB-6too: Crystal structure of human BCL6 BTB domain in complex with compound 11a 手法: X-RAY DIFFRACTION / 解像度: 1.53 Å
化合物	ChemComp-NQE: 2-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)amino]pyridine-3-carbonitrile ChemComp-EDO: 1,2-ETHANEDIOL / エチレングリコ-ル ChemComp-HOH: WATER ChemComp-NQH: 2-chloranyl-4-(cyclopropylmethylamino)pyridine-3-carbonitrile ChemComp-DMS: DIMETHYL SULFOXIDE / 2-チアプロパン2-オキシド / DMSO, 沈殿剤YM ChemComp-CL: Unknown entry / クロリド ChemComp-NQK: 2-chloranyl-4-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)amino]pyridine-3-carbonitrile ChemComp-NQN: 2-chloranyl-4-[[1-methyl-3-[(3~{R})-3-oxidanylbutyl]-2-oxidanylidene-benzimidazol-5-yl]amino]pyridine-3-carbonitrile ChemComp-NQQ: 2-chloranyl-4-[[1-methyl-3-(3-methyl-3-oxidanyl-butyl)-2-oxidanylidene-benzimidazol-5-yl]amino]pyridine-3-carbonitrile ChemComp-NQT: 5-[[5-chloranyl-2-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]amino]-1-methyl-3-(3-methyl-3-oxidanyl-butyl)benzimidazol-2-one ChemComp-NQW: 5-[[5-chloranyl-2-[(2~{S},6~{R})-2,6-dimethylmorpholin-4-yl]pyrimidin-4-yl]amino]-1-methyl-3-(3-methyl-3-oxidanyl-butyl)benzimidazol-2-one ChemComp-NQZ: 5-[[2-[(3~{S},5~{R})-4,4-bis(fluoranyl)-3,5-dimethyl-piperidin-1-yl]-5-chloranyl-pyrimidin-4-yl]amino]-1-methyl-3-(3-methyl-3-oxidanyl-butyl)benzimidazol-2-one ChemComp-NR5: 5-[[5-chloranyl-2-(2,2,6,6-tetramethylmorpholin-4-yl)pyrimidin-4-yl]amino]-1-methyl-3-(3-methyl-3-oxidanyl-butyl)benzimidazol-2-one ChemComp-NR8*: 2-chloranyl-4-[[1-methyl-3-[(2~{S})-2-oxidanylbutyl]-2-oxidanylidene-benzimidazol-5-yl]amino]pyridine-3-carbonitrile
由来	homo sapiens (ヒト) synthetic construct (人工物)
キーワード	TRANSCRIPTION / Cancer / Lymphoma / Inhibitor / Degrader