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TitleKinase domain inhibition of leucine rich repeat kinase 2 (LRRK2) using a [1,2,4]triazolo[4,3-b]pyridazine scaffold.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 24, Page 4132-4140, Year 2014
Publish dateMar 25, 2014 (structure data deposition date)
AuthorsGalatsis, P. / Henderson, J.L. / Kormos, B.L. / Han, S. / Kurumbail, R.G. / Wager, T.T. / Verhoest, P.R. / Noell, G.S. / Chen, Y. / Needle, E. ...Galatsis, P. / Henderson, J.L. / Kormos, B.L. / Han, S. / Kurumbail, R.G. / Wager, T.T. / Verhoest, P.R. / Noell, G.S. / Chen, Y. / Needle, E. / Berger, Z. / Steyn, S.J. / Houle, C. / Hirst, W.D.
External linksBioorg. Med. Chem. Lett. / PubMed:25113930
MethodsX-ray diffraction
Resolution2.16 Å
Structure data

PDB-4py1:
Crystal structure of Tyk2 in complex with compound 15, 6-((2,5-dimethoxyphenyl)thio)-3-(1-methyl-1H-pyrazol-4-yl)-[1,2,4]triazolo[4,3-b]pyridazine
Method: X-RAY DIFFRACTION / Resolution: 2.16 Å

Chemicals

ChemComp-2YK:
6-[(2,5-dimethoxyphenyl)sulfanyl]-3-(1-methyl-1H-pyrazol-4-yl)[1,2,4]triazolo[4,3-b]pyridazine

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / kinase

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