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TitlePhenotypic Discovery of Triazolo[1,5- c ]quinazolines as a First-In-Class Bone Morphogenetic Protein Amplifier Chemotype.
Journal, issue, pagesJ. Med. Chem., Vol. 65, Page 15263-15281, Year 2022
Publish dateMar 24, 2021 (structure data deposition date)
AuthorsWesseler, F. / Lohmann, S. / Riege, D. / Halver, J. / Roth, A. / Pichlo, C. / Weber, S. / Takamiya, M. / Muller, E. / Ketzel, J. ...Wesseler, F. / Lohmann, S. / Riege, D. / Halver, J. / Roth, A. / Pichlo, C. / Weber, S. / Takamiya, M. / Muller, E. / Ketzel, J. / Flegel, J. / Gihring, A. / Rastegar, S. / Bertrand, J. / Baumann, U. / Knippschild, U. / Peifer, C. / Sievers, S. / Waldmann, H. / Schade, D.
External linksJ. Med. Chem. / PubMed:36346705
MethodsX-ray diffraction
Resolution1.85 Å
Structure data

PDB-7nzy:
Crystal structure of human Casein Kinase I delta in complex with CGS-15943
Method: X-RAY DIFFRACTION / Resolution: 1.85 Å

Chemicals

ChemComp-UX2:
9-chloranyl-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine / antagonist*YM

ChemComp-MLI:
MALONATE ION

ChemComp-PO4:
PHOSPHATE ION

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / Kinase / Inhibitor / Complex / ATP-competitive

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