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-Structure paper
Title | Discovery of cyclic sulfoxide hydroxyethylamines as potent and selective beta-site APP-cleaving enzyme 1 (BACE1) inhibitors: structure based design and in vivo reduction of amyloid beta-peptides. |
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Journal, issue, pages | Bioorg. Med. Chem. Lett., Vol. 23, Page 5300-5306, Year 2013 |
Publish date | Jul 29, 2013 (structure data deposition date) |
![]() | Rueeger, H. / Lueoend, R. / Machauer, R. / Veenstra, S.J. / Jacobson, L.H. / Staufenbiel, M. / Desrayaud, S. / Rondeau, J.M. / Mobitz, H. / Neumann, U. |
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Methods | X-ray diffraction |
Resolution | 1.95 - 2.3 Å |
Structure data | ![]() PDB-4lxa: ![]() PDB-4lxk: ![]() PDB-4lxm: |
Chemicals | ![]() ChemComp-1YS: ![]() ChemComp-GOL: ![]() ChemComp-PO4: ![]() ChemComp-HOH: ![]() ChemComp-1YT: ![]() ChemComp-1YU: |
Source |
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![]() | HYDROLASE/HYDROLASE INHIBITOR / Structure-based drug design / Aspartyl protease / Membrane / HYDROLASE-HYDROLASE INHIBITOR complex |