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	Exploitation of a Novel Binding Pocket in Human Lipoprotein-Associated Phospholipase A2 (Lp-PLA2) Discovered through X-ray Fragment Screening.
ジャーナル・号・ページ	J. Med. Chem., Vol. 59, Page 5356-5367, Year 2016
掲載日	2016年4月12日 (構造データの登録日)
著者	Woolford, A.J. / Pero, J.E. / Aravapalli, S. / Berdini, V. / Coyle, J.E. / Day, P.J. / Dodson, A.M. / Grondin, P. / Holding, F.P. / Lee, L.Y. ...Woolford, A.J. / Pero, J.E. / Aravapalli, S. / Berdini, V. / Coyle, J.E. / Day, P.J. / Dodson, A.M. / Grondin, P. / Holding, F.P. / Lee, L.Y. / Li, P. / Manas, E.S. / Marino, J. / Martin, A.C. / McCleland, B.W. / McMenamin, R.L. / Murray, C.W. / Neipp, C.E. / Page, L.W. / Patel, V.K. / Potvain, F. / Rich, S. / Rivero, R.A. / Smith, K. / Somers, D.O. / Trottet, L. / Velagaleti, R. / Williams, G. / Xie, R.
リンク	J. Med. Chem. / PubMed:27167608
手法	X線回折
解像度	1.95 - 2.46 Å
構造データ	PDB-5jad: Compound binding to Human Lipoprotein-Associated Phospholipase A2 (Lp-PLA2)discovered through fragment screening 手法: X-RAY DIFFRACTION / 解像度: 2.05 Å PDB-5jah: Exploitation of a Novel Binding Pocket in Human Lipoprotein-Associated Phospholipase A2 (Lp-PLA₂) Discovered Through X-Ray Fragment Screening 手法: X-RAY DIFFRACTION / 解像度: 2.06 Å PDB-5jal: Exploitation of a Novel Binding Pocket in Human Lipoprotein-Associated Phospholipase A2 (Lp-PLA₂) Discovered Through X-Ray Fragment Screening 手法: X-RAY DIFFRACTION / 解像度: 2.06 Å PDB-5jan: Exploitation of a Novel Binding Pocket in Human Lipoprotein-Associated Phospholipase A2 (Lp-PLA₂) Discovered Through X-Ray Fragment Screening 手法: X-RAY DIFFRACTION / 解像度: 2.12 Å PDB-5jao: Exploitation of a Novel Binding Pocket in Human Lipoprotein-Associated Phospholipase A2 (Lp-PLA₂) Discovered Through X-Ray Fragment Screening 手法: X-RAY DIFFRACTION / 解像度: 2.06 Å PDB-5jap: Exploitation of a Novel Binding Pocket in Human Lipoprotein-Associated Phospholipase A2 (Lp-PLA₂) Discovered Through X-Ray Fragment Screening 手法: X-RAY DIFFRACTION / 解像度: 2.46 Å PDB-5jar: Exploitation of a Novel Binding Pocket in Human Lipoprotein-Associated Phospholipase A2 (Lp-PLA₂) Discovered Through X-Ray Fragment Screening 手法: X-RAY DIFFRACTION / 解像度: 2.11 Å PDB-5jas: Exploitation of a Novel Binding Pocket in Human Lipoprotein-Associated Phospholipase A2 (Lp-PLA₂) Discovered Through X-Ray Fragment Screening 手法: X-RAY DIFFRACTION / 解像度: 2.06 Å PDB-5jat: Exploitation of a Novel Binding Pocket in Human Lipoprotein-Associated Phospholipase A2 (Lp-PLA₂) Discovered Through X-Ray Fragment Screening 手法: X-RAY DIFFRACTION / 解像度: 2.04 Å PDB-5jau: Exploitation of a Novel Binding Pocket in Human Lipoprotein-Associated Phospholipase A2 (Lp-PLA₂) Discovered Through X-Ray Fragment Screening 手法: X-RAY DIFFRACTION / 解像度: 1.95 Å
化合物	ChemComp-MG: Unknown entry / マグネシウムジカチオン ChemComp-CL: Unknown entry / クロリド ChemComp-DMS: DIMETHYL SULFOXIDE / 2-チアプロパン2-オキシド / DMSO, 沈殿剤YM ChemComp-FB2: benzenesulfonamide / ベンゼンスルホンアミド ChemComp-HOH: WATER ChemComp-6HQ: 1,5,5-trimethylimidazolidine-2,4-dione / 1,5,5-トリメチルヒダントイン ChemComp-6HO: (2,5-dihydro-1H-pyrrol-1-yl)(3-fluorophenyl)methanone ChemComp-CA: Unknown entry / カルシウムジカチオン ChemComp-6HP: 1,3-dimethyl-6-(2-methylpropoxy)pyrimidine-2,4(1H,3H)-dione ChemComp-6HX: 2'-chloro-6-methyl[1,1'-biphenyl]-3-amine ChemComp-6HZ: (2,5-dihydro-1H-pyrrol-1-yl)(2',6-dimethyl[1,1'-biphenyl]-3-yl)methanone ChemComp-6HV: (2',6-dimethyl[1,1'-biphenyl]-3-yl)(1,3-thiazol-2-yl)methanone ChemComp-6HW: N-(2',6-dimethyl[1,1'-biphenyl]-3-yl)-1,3-thiazol-2-amine ChemComp-6HR: 3-{2-[(2',6-dimethyl[1,1'-biphenyl]-3-yl)amino]-1,3-thiazol-4-yl}propan-1-ol ChemComp-6HU*: (2S)-3-(3-{[4-(2-aminoethoxy)-2',6-dimethyl[1,1'-biphenyl]-3-yl]amino}-1H-pyrazol-1-yl)-2-methoxypropan-1-ol
由来	homo sapiens (ヒト)
キーワード	HYDROLASE / phospholipase / lipid metabolism