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TitleDesign, Synthesis, Crystallographic Studies, and Preliminary Biological Appraisal of New Substituted Triazolo[4,3-b]pyridazin-8-amine Derivatives as Tankyrase Inhibitors.
Journal, issue, pagesJ. Med. Chem., Vol. 57, Page 2807-2812, Year 2014
Publish dateAug 12, 2013 (structure data deposition date)
AuthorsLiscio, P. / Carotti, A. / Asciutti, S. / Karlberg, T. / Bellocchi, D. / Llacuna, L. / Macchiarulo, A. / Aaronson, S.A. / Schuler, H. / Pellicciari, R. / Camaioni, E.
External linksJ. Med. Chem. / PubMed:24527792
MethodsX-ray diffraction
Resolution1.95 Å
Structure data

PDB-4m7b:
Human tankyrase 2 - catalytic Parp domain in complex with an inhibitor UPF1854
Method: X-RAY DIFFRACTION / Resolution: 1.95 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-28C:
4-{2-[(6-methyl[1,2,4]triazolo[4,3-b]pyridazin-8-yl)amino]ethyl}phenol

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / DIPHTHERIA TOXIN LIKE ADP-RIBOSE TRANSFERASE DOMAIN / POLY ADP-RIBOSYLATION / TRANSFERASE-TRANSFERASE INHIBITOR complex

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