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Structure paper

TitleA new class of small molecule inhibitor of BMP signaling.
Journal, issue, pagesPlos One, Vol. 8, Page e62721-e62721, Year 2013
Publish dateApr 30, 2010 (structure data deposition date)
AuthorsSanvitale, C.E. / Kerr, G. / Chaikuad, A. / Ramel, M.C. / Mohedas, A.H. / Reichert, S. / Wang, Y. / Triffitt, J.T. / Cuny, G.D. / Yu, P.B. ...Sanvitale, C.E. / Kerr, G. / Chaikuad, A. / Ramel, M.C. / Mohedas, A.H. / Reichert, S. / Wang, Y. / Triffitt, J.T. / Cuny, G.D. / Yu, P.B. / Hill, C.S. / Bullock, A.N.
External linksPlos One / PubMed:23646137
MethodsX-ray diffraction
Resolution1.82 - 2.15 Å
Structure data

PDB-3mtf:
Crystal structure of the ACVR1 kinase in complex with a 2-aminopyridine inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.15 Å

PDB-3q4u:
Crystal structure of the ACVR1 kinase domain in complex with LDN-193189
Method: X-RAY DIFFRACTION / Resolution: 1.82 Å

Chemicals

ChemComp-PO4:
PHOSPHATE ION

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-A3F:
3-[6-amino-5-(3,4,5-trimethoxyphenyl)pyridin-3-yl]phenol

ChemComp-HOH:
WATER

ChemComp-LDN:
4-[6-(4-piperazin-1-ylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]quinoline

ChemComp-FLC:
CITRATE ANION

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / Protein Kinase / Structural Genomics / Structural Genomics Consortium / SGC

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