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Structure paper

TitleSynthesis of glutamic acid analogs as potent inhibitors of leukotriene A4 hydrolase.
Journal, issue, pagesBioorg. Med. Chem., Vol. 16, Page 4963-4983, Year 2008
Publish dateMar 10, 2008 (structure data deposition date)
AuthorsKirkland, T.A. / Adler, M. / Bauman, J.G. / Chen, M. / Haeggstrom, J.Z. / King, B. / Kochanny, M.J. / Liang, A.M. / Mendoza, L. / Phillips, G.B. ...Kirkland, T.A. / Adler, M. / Bauman, J.G. / Chen, M. / Haeggstrom, J.Z. / King, B. / Kochanny, M.J. / Liang, A.M. / Mendoza, L. / Phillips, G.B. / Thunnissen, M. / Trinh, L. / Whitlow, M. / Ye, B. / Ye, H. / Parkinson, J. / Guilford, W.J.
External linksBioorg. Med. Chem. / PubMed:18394906
MethodsX-ray diffraction
Resolution1.8 - 2.55 Å
Structure data

PDB-3cho:
Crystal structure of leukotriene a4 hydrolase in complex with 2-amino-N-[4-(phenylmethoxy)phenyl]-acetamide
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

PDB-3chp:
Crystal structure of leukotriene a4 hydrolase in complex with (3S)-3-amino-4-oxo-4-[(4-phenylmethoxyphenyl)amino]butanoic acid
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-3chq:
Crystal structure of leukotriene a4 hydrolase in complex with N5-[4-(phenylmethoxy)phenyl]-L-glutamine
Method: X-RAY DIFFRACTION / Resolution: 2.09 Å

PDB-3chr:
Crystal structure of leukotriene A4 hydrolase in complex with 4-amino-N-[4-(phenylmethoxy)phenyl]-butanamide
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-3chs:
Crystal structure of leukotriene A4 hydrolase in complex with (2S)-2-amino-5-[[4-[(2S)-2-hydroxy-2-phenyl-ethoxy]phenyl]amino]-5-oxo-pentanoic acid
Method: X-RAY DIFFRACTION / Resolution: 2.55 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-YB:
YTTERBIUM (III) ION

ChemComp-ACT:
ACETATE ION

ChemComp-4BG:
N-[4-(benzyloxy)phenyl]glycinamide

ChemComp-HOH:
WATER

ChemComp-IMD:
IMIDAZOLE

ChemComp-4BO:
(3S)-3-amino-4-oxo-4-[(4-phenylmethoxyphenyl)amino]butanoic acid

ChemComp-4BQ:
(2S)-2-amino-5-oxo-5-[(4-phenylmethoxyphenyl)amino]pentanoic acid

ChemComp-4BS:
4-amino-N-[4-(benzyloxy)phenyl]butanamide

ChemComp-4BU:
(2S)-2-amino-5-[[4-[(2S)-2-hydroxy-2-phenyl-ethoxy]phenyl]amino]-5-oxo-pentanoic acid

Source
  • homo sapiens (human)
KeywordsHYDROLASE / EPOXIDE HYDROLASE / ALPHA-BETA PROTEIN / LEUKOTRIENE BIOSYNTHESIS / METALLOPROTEASE / Inhibitor complex / Alternative splicing / Cytoplasm / Metal-binding / Multifunctional enzyme / Zinc

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