Database of articles cited by EMDB/PDB/SASBDB data

Keywords
Structure methods	All X-ray diffraction NMR electron microscopy small angle scattering neutron diffraction fiber diffraction powder diffraction infrared spectroscopy EPR fluorescence transfer theoretical model Hybrid
Author
Journal
IF	>30 >20 >10 >5 all

Title	Discovery of leukotriene A4 hydrolase inhibitors using metabolomics biased fragment crystallography.
Journal, issue, pages	J. Med. Chem., Vol. 52, Page 4694-4715, Year 2009
Publish date	Jan 13, 2009 (structure data deposition date)
Authors	Davies, D.R. / Mamat, B. / Magnusson, O.T. / Christensen, J. / Haraldsson, M.H. / Mishra, R. / Pease, B. / Hansen, E. / Singh, J. / Zembower, D. ...Davies, D.R. / Mamat, B. / Magnusson, O.T. / Christensen, J. / Haraldsson, M.H. / Mishra, R. / Pease, B. / Hansen, E. / Singh, J. / Zembower, D. / Kim, H. / Kiselyov, A.S. / Burgin, A.B. / Gurney, M.E. / Stewart, L.J.
External links	J. Med. Chem. / PubMed:19618939
Methods	X-ray diffraction
Resolution	1.58 - 2.6 Å
Structure data	PDB-3fts: Leukotriene A4 hydrolase in complex with resveratrol Method: X-RAY DIFFRACTION / Resolution: 2.33 Å PDB-3ftu: Leukotriene A4 hydrolase in complex with dihydroresveratrol Method: X-RAY DIFFRACTION / Resolution: 1.9 Å PDB-3ftv: Leukotriene A4 hydrolase in complex with fragment N-(pyridin-3-ylmethyl)aniline Method: X-RAY DIFFRACTION / Resolution: 1.7 Å PDB-3ftw: Leukotriene A4 hydrolase in complex with fragments N-(pyridin-3-ylmethyl)aniline and acetate Method: X-RAY DIFFRACTION / Resolution: 1.85 Å PDB-3ftx: Leukotriene A4 hydrolase in complex with dihydroresveratrol and bestatin Method: X-RAY DIFFRACTION / Resolution: 1.96 Å PDB-3fty: Leukotriene A4 hydrolase in complex with fragment 3-(benzyloxy)pyridin-2-amine Method: X-RAY DIFFRACTION / Resolution: 2.15 Å PDB-3fu0: Leukotriene A4 hydrolase in complex with fragment 4-(4-fluorobenzoyl)pyridine Method: X-RAY DIFFRACTION / Resolution: 1.8 Å PDB-3fu3: Leukotriene A4 hydrolase in complex with fragment 4-(2-amino-1,3-thiazol-4-yl)phenol Method: X-RAY DIFFRACTION / Resolution: 2 Å PDB-3fu5: Leukotriene A4 hydrolase in complex with (5-thiophen-2-ylthiophen-2-yl)methylamine Method: X-RAY DIFFRACTION / Resolution: 2.3 Å PDB-3fu6: Leukotriene A4 hydrolase in complex with fragment (4-thiophen-2-ylphenyl)methanamine Method: X-RAY DIFFRACTION / Resolution: 2.05 Å PDB-3fud: Leukotriene A4 hydrolase in complex with N-methyl-1-(2-thiophen-2-ylphenyl)methanamine Method: X-RAY DIFFRACTION / Resolution: 2.2 Å PDB-3fue: Leukotriene A4 hydrolase in complex with fragment 5-chloroindole and bestatin Method: X-RAY DIFFRACTION / Resolution: 2.38 Å PDB-3fuf: Leukotriene A4 hydrolase in complex with fragment 5-fluoroindole and bestatin Method: X-RAY DIFFRACTION / Resolution: 2.6 Å PDB-3fuh: Leukotriene A4 hydrolase in complex with fragment 5-hydroxyindole and bestatin Method: X-RAY DIFFRACTION / Resolution: 1.8 Å PDB-3fui: Leukotriene A4 hydrolase in complex with N-benzyl-4-[(2R)-pyrrolidin-2-ylmethoxy]aniline Method: X-RAY DIFFRACTION / Resolution: 2.2 Å PDB-3fuj: Leukotriene A4 hydrolase in complex with 5-[2-(1H-pyrrol-1-yl)ethoxy]-1H-indole Method: X-RAY DIFFRACTION / Resolution: 1.9 Å PDB-3fuk: Leukotriene A4 hydrolase in complex with 1-[2-(1H-indol-5-yloxy)ethyl]piperidine-4-carboxylic acid Method: X-RAY DIFFRACTION / Resolution: 1.95 Å PDB-3fum: Leukotriene A4 hydrolase in complex with (R)-pyridin-4-yl[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol Method: X-RAY DIFFRACTION / Resolution: 2.15 Å PDB-3fun: Leukotriene A4 hydrolase in complex with {4-[(2R)-pyrrolidin-2-ylmethoxy]phenyl}(4-thiophen-3-ylphenyl)methanone Method: X-RAY DIFFRACTION / Resolution: 1.58 Å
Chemicals	ChemComp-ZN: Unknown entry ChemComp-YB: YTTERBIUM (III) ION ChemComp-STL: RESVERATROL ChemComp-ACT: ACETATE ION ChemComp-IMD: IMIDAZOLE ChemComp-HOH: WATER ChemComp-RE2: 5-[2-(4-hydroxyphenyl)ethyl]benzene-1,3-diol ChemComp-11X: N-(pyridin-3-ylmethyl)aniline ChemComp-BES: 2-(3-AMINO-2-HYDROXY-4-PHENYL-BUTYRYLAMINO)-4-METHYL-PENTANOIC ACID / protease inhibitorYM ChemComp-3IP: 3-(BENZYLOXY)PYRIDIN-2-AMINE ChemComp-22F: (4-fluorophenyl)(pyridin-4-yl)methanone ChemComp-92G: 4-(2-amino-1,3-thiazol-4-yl)phenol ChemComp-492: 1-(2,2'-bithiophen-5-yl)methanamine ChemComp-80G: 1-(4-thiophen-2-ylphenyl)methanamine ChemComp-692: N-methyl-1-(2-thiophen-2-ylphenyl)methanamine ChemComp-11S: 5-chloro-1H-indole ChemComp-14O: 5-fluoro-1H-indole ChemComp-5H1: 1H-indol-5-ol ChemComp-812: N-benzyl-4-[(2R)-pyrrolidin-2-ylmethoxy]aniline ChemComp-00G: 5-[2-(1H-pyrrol-1-yl)ethoxy]-1H-indole ChemComp-58Z: 1-[2-(1H-indol-5-yloxy)ethyl]piperidine-4-carboxylic acid ChemComp-80A: (R)-pyridin-4-yl[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol ChemComp-798*: {4-[(2R)-pyrrolidin-2-ylmethoxy]phenyl}(4-thiophen-3-ylphenyl)methanone
Source	homo sapiens (human)
Keywords	HYDROLASE / Leukotriene A4 Hydrolase / LTA4H / Fragment crystallography / Fragments of Life / FOL / Resveratrol / Alternative splicing / Cytoplasm / Leukotriene biosynthesis / Metal-binding / Metalloprotease / Multifunctional enzyme / Polymorphism / Protease / Zinc