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Structure paper

TitleNovel benzimidazole derivatives as phosphodiesterase 10A (PDE10A) inhibitors with improved metabolic stability.
Journal, issue, pagesBioorg. Med. Chem., Vol. 22, Page 3515-3526, Year 2014
Publish dateMar 4, 2014 (structure data deposition date)
AuthorsChino, A. / Masuda, N. / Amano, Y. / Honbou, K. / Mihara, T. / Yamazaki, M. / Tomishima, M.
External linksBioorg. Med. Chem. / PubMed:24837154
MethodsX-ray diffraction
Resolution2.6 - 2.99 Å
Structure data

PDB-3ws8:
Crystal structure of PDE10A in complex with a benzimidazole inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

PDB-3ws9:
Crystal structure of PDE10A in complex with a benzimdazole inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.99 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-MG:
Unknown entry

ChemComp-X4C:
8-methyl-6-[2-(5-methyl-1-phenyl-1H-benzimidazol-2-yl)ethyl]imidazo[1,5-a]pyrimidine

ChemComp-HOH:
WATER

ChemComp-X4D:
7-[2-(5-methyl-1-phenyl-1H-benzimidazol-2-yl)ethyl]imidazo[1,5-b]pyridazine

Source
  • homo sapiens (human)
KeywordsHYDROLASE/HYDROLASE INHIBITOR / phosphodiesterase / HYDROLASE-HYDROLASE INHIBITOR complex

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