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TitleSynthesis and Structure-Activity Relationships of 3,5-Disubstituted-pyrrolo[2,3- b]pyridines as Inhibitors of Adaptor-Associated Kinase 1 with Antiviral Activity.
Journal, issue, pagesJ. Med. Chem., Year 2019
Publish dateMay 26, 2016 (structure data deposition date)
AuthorsVerdonck, S. / Pu, S.Y. / Sorrell, F.J. / Elkins, J.M. / Froeyen, M. / Gao, L.J. / Prugar, L.I. / Dorosky, D.E. / Brannan, J.M. / Barouch-Bentov, R. ...Verdonck, S. / Pu, S.Y. / Sorrell, F.J. / Elkins, J.M. / Froeyen, M. / Gao, L.J. / Prugar, L.I. / Dorosky, D.E. / Brannan, J.M. / Barouch-Bentov, R. / Knapp, S. / Dye, J.M. / Herdewijn, P. / Einav, S. / De Jonghe, S.
External linksJ. Med. Chem. / PubMed:31136173
MethodsX-ray diffraction
Resolution1.97 Å
Structure data

PDB-5l4q:
Crystal Structure of Adaptor Protein 2 Associated Kinase 1 (AAK1) in Complex with LKB1 (AAK1 Dual Inhibitor)
Method: X-RAY DIFFRACTION / Resolution: 1.97 Å

Chemicals

ChemComp-LKB:
~{N}-[5-(4-cyanophenyl)-1~{H}-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / Kinase Kinase domain

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