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Structure paper

TitleSaracatinib is an efficacious clinical candidate for fibrodysplasia ossificans progressiva.
Journal, issue, pagesJCI Insight, Vol. 6, Year 2021
Publish dateJun 18, 2020 (structure data deposition date)
AuthorsWilliams, E. / Bagarova, J. / Kerr, G. / Xia, D.D. / Place, E.S. / Dey, D. / Shen, Y. / Bocobo, G.A. / Mohedas, A.H. / Huang, X. ...Williams, E. / Bagarova, J. / Kerr, G. / Xia, D.D. / Place, E.S. / Dey, D. / Shen, Y. / Bocobo, G.A. / Mohedas, A.H. / Huang, X. / Sanderson, P.E. / Lee, A. / Zheng, W. / Economides, A.N. / Smith, J.C. / Yu, P.B. / Bullock, A.N.
External linksJCI Insight / PubMed:33705358
MethodsX-ray diffraction
Resolution2.67 Å
Structure data

PDB-6zgc:
Crystal structure of the ACVR1 (ALK2) kinase in complex with the compound Saracatinib (AZD0530)
Method: X-RAY DIFFRACTION / Resolution: 2.67 Å

Chemicals

ChemComp-H8H:
N-(5-CHLORO-1,3-BENZODIOXOL-4-YL)-7-[2-(4-METHYLPIPERAZIN-1-YL)ETHOXY]-5-(TETRAHYDRO-2H-PYRAN-4-YLOXY)QUINAZOLIN-4-AMINE / inhibitor*YM

ChemComp-K:
Unknown entry

ChemComp-PO4:
PHOSPHATE ION

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsSIGNALING PROTEIN / Inhibitor complex. Kinase. Type I receptor / BMP / Signalling.

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