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Title | Orally Active 7-Substituted (4-Benzylphthalazin-1-yl)-2-methylpiperazin-1-yl]nicotinonitriles as Active-Site Inhibitors of Sphingosine 1-Phosphate Lyase for the Treatment of Multiple Sclerosis. |
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Journal, issue, pages | J. Med. Chem., Vol. 57, Page 5074-5084, Year 2014 |
Publish date | Apr 23, 2014 (structure data deposition date) |
![]() | Weiler, S. / Braendlin, N. / Beerli, C. / Bergsdorf, C. / Schubart, A. / Srinivas, H. / Oberhauser, B. / Billich, A. |
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Methods | X-ray diffraction |
Resolution | 2.4 Å |
Structure data | ![]() PDB-4q6r: |
Chemicals | ![]() ChemComp-SIN: ![]() ChemComp-GOL: ![]() ChemComp-30J: ![]() ChemComp-PO4: ![]() ChemComp-HOH: |
Source |
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![]() | Lyase/Lyase inhibitor / PLP / pyridoxal 5-phosphate-dependent enzymes / Lyase-Lyase inhibitor complex |