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Title | Highly potent macrocyclic BACE-1 inhibitors incorporating a hydroxyethylamine core: design, synthesis and X-ray crystal structures of enzyme inhibitor complexes. |
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Journal, issue, pages | Bioorg. Med. Chem., Vol. 20, Page 4377-4389, Year 2012 |
Publish date | Feb 13, 2012 (structure data deposition date) |
![]() | Sandgren, V. / Agback, T. / Johansson, P.O. / Lindberg, J. / Kvarnstrom, I. / Samuelsson, B. / Belda, O. / Dahlgren, A. |
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Methods | X-ray diffraction |
Resolution | 1.8 - 1.9 Å |
Structure data | ![]() PDB-4dpf: ![]() PDB-4dpi: |
Chemicals | ![]() ChemComp-0LG: ![]() ChemComp-HOH: ![]() ChemComp-0N1: |
Source |
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![]() | Hydrolase/Hydrolase inhibitor / BACE1 / ASP2 / BACE / macrocycle / Hydrolase-Hydrolase inhibitor complex |