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Structure paper

TitleInsight into Binding of Phosphodiesterase-9A Selective Inhibitors by Crystal Structures and Mutagenesis
Journal, issue, pagesJ. Med. Chem., Vol. 53, Page 1726-1731, Year 2010
Publish dateOct 2, 2009 (structure data deposition date)
AuthorsWang, H. / Luo, X. / Ye, M. / Hou, J. / Robinson, H. / Ke, H.
External linksJ. Med. Chem. / PubMed:20121115
MethodsX-ray diffraction
Resolution2.5 - 2.7 Å
Structure data

PDB-3k3e:
Crystal structure of the PDE9A catalytic domain in complex with (R)-BAY73-6691
Method: X-RAY DIFFRACTION / Resolution: 2.7 Å

PDB-3k3h:
Crystal structure of the PDE9A catalytic domain in complex with (S)-BAY73-6691
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-MG:
Unknown entry

ChemComp-PDB:
1-(2-chlorophenyl)-6-[(2R)-3,3,3-trifluoro-2-methylpropyl]-1,7-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one

ChemComp-HOH:
WATER

ChemComp-BYE:
1-(2-chlorophenyl)-6-[(2S)-3,3,3-trifluoro-2-methylpropyl]-1,7-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one

Source
  • homo sapiens (human)
KeywordsHYDROLASE / PDE9 / catalytic domain / cGMP / Manganese / Metal-binding / Phosphoprotein

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