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	Discovery of 4-[(2S)-2-{[4-(4-chlorophenoxy)phenoxy]methyl}-1-pyrrolidinyl]butanoic acid (DG-051) as a novel leukotriene A4 hydrolase inhibitor of leukotriene B4 biosynthesis.
ジャーナル・号・ページ	J. Med. Chem., Vol. 53, Page 573-585, Year 2010
掲載日	2008年12月8日 (構造データの登録日)
著者	Sandanayaka, V. / Mamat, B. / Mishra, R.K. / Winger, J. / Krohn, M. / Zhou, L.M. / Keyvan, M. / Enache, L. / Sullins, D. / Onua, E. ...Sandanayaka, V. / Mamat, B. / Mishra, R.K. / Winger, J. / Krohn, M. / Zhou, L.M. / Keyvan, M. / Enache, L. / Sullins, D. / Onua, E. / Zhang, J. / Halldorsdottir, G. / Sigthorsdottir, H. / Thorlaksdottir, A. / Sigthorsson, G. / Thorsteinnsdottir, M. / Davies, D.R. / Stewart, L.J. / Zembower, D.E. / Andresson, T. / Kiselyov, A.S. / Singh, J. / Gurney, M.E.
リンク	J. Med. Chem. / PubMed:19950900
手法	X線回折
解像度	1.63 - 2.39 Å
構造データ	PDB-3fh5: Leukotriene A4 Hydrolase complexed with inhibitor (2R)-2-[(4-benzylphenoxy)methyl]pyrrolidine. 手法: X-RAY DIFFRACTION / 解像度: 1.63 Å PDB-3fh7: Leukotriene A4 Hydrolase complexed with inhibitor 4-[(2S)-2-{[4-(4-chlorophenoxy)phenoxy]methyl}pyrrolidin-1-yl]butanoate. 手法: X-RAY DIFFRACTION / 解像度: 2.05 Å PDB-3fh8: Leukotriene A4 Hydrolase complexed with inhibitor 1-[2-(4-benzylphenoxy)ethyl]pyrrolidine. 手法: X-RAY DIFFRACTION / 解像度: 1.67 Å PDB-3fhe: Leukotriene A4 Hydrolase complexed with inhibitor N-[3-(4-benzylphenoxy)propyl]-N-methyl-beta-alanine. 手法: X-RAY DIFFRACTION / 解像度: 2.16 Å PDB-3ftz: Leukotriene A4 hydrolase in complex with fragment 2-(pyridin-3-ylmethoxy)aniline 手法: X-RAY DIFFRACTION / 解像度: 2 Å PDB-3ful: Leukotriene A4 hydrolase in complex with pyridin-4-yl[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanone 手法: X-RAY DIFFRACTION / 解像度: 2.39 Å
化合物	ChemComp-ZN: Unknown entry ChemComp-YB: YTTERBIUM (III) ION ChemComp-ACT: ACETATE ION / 酢酸イオン ChemComp-IMD: IMIDAZOLE / 1H-イミダゾ-ル-3-カチオン ChemComp-24P: (2R)-2-[(4-benzylphenoxy)methyl]pyrrolidine ChemComp-GOL: GLYCEROL / グリセロ-ル ChemComp-HOH: WATER ChemComp-25P: 4-[(2S)-2-{[4-(4-chlorophenoxy)phenoxy]methyl}pyrrolidin-1-yl]butanoate ChemComp-27P: 1-[2-(4-benzylphenoxy)ethyl]pyrrolidine / 1-[2-(4-ベンジルフェノキシ)エチル]ピロリジン ChemComp-28P: N-[3-(4-benzylphenoxy)propyl]-N-methyl-beta-alanine / SC-57461 ChemComp-848: 2-(pyridin-3-ylmethoxy)aniline ChemComp-52D: pyridin-4-yl[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanone
由来	homo sapiens (ヒト)
キーワード	HYDROLASE/HYDROLASE INHIBITOR / LTA4H / Leukotriene A4 / Leukotriene B4 Biosynthesis / Peptidase / Hydrolase-hydrolase inhibitor complex / Structure Based Drug Design / Leukotriene biosynthesis / Metal-binding / Metalloprotease / Multifunctional enzyme / Protease / Leukotriene A4 Hydrolase / Fragment crystallography / Fragments of Life / FOL