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TitleIdentification of Noncompetitive Inhibitors of Cytosolic 5'-Nucleotidase II Using a Fragment-Based Approach.
Journal, issue, pagesJ. Med. Chem., Vol. 58, Page 9680-9696, Year 2015
Publish dateJul 22, 2015 (structure data deposition date)
AuthorsMarton, Z. / Guillon, R. / Krimm, I. / Rahimova, R. / Egron, D. / Jordheim, L.P. / Aghajari, N. / Dumontet, C. / Perigaud, C. / Lionne, C. ...Marton, Z. / Guillon, R. / Krimm, I. / Rahimova, R. / Egron, D. / Jordheim, L.P. / Aghajari, N. / Dumontet, C. / Perigaud, C. / Lionne, C. / Peyrottes, S. / Chaloin, L.
External linksJ. Med. Chem. / PubMed:26599519
MethodsX-ray diffraction
Resolution2.9 Å
Structure data

PDB-5cqz:
Human cytosolic 5'-nucleotidase II in complex with 3-(3-Imidazol-1-ylphenyl)-N-(9H-purin-6-yl)benzamide
Method: X-RAY DIFFRACTION / Resolution: 2.9 Å

PDB-5cr7:
Human cytosolic 5'-nucleotidase II in complex with N-(9H-Purin-6-yl)-3-(3-pyrrol-1-ylphenyl)benzamide
Method: X-RAY DIFFRACTION / Resolution: 2.9 Å

Chemicals

ChemComp-GOL:
GLYCEROL

ChemComp-SO4:
SULFATE ION

ChemComp-MG:
Unknown entry

ChemComp-53O:
1-(biphenyl-3-yl)-1H-imidazole

ChemComp-HOH:
WATER

ChemComp-5WO:
~{N}-(7~{H}-purin-6-yl)-3-(3-pyrrol-1-ylphenyl)benzamide

ChemComp-ACT:
ACETATE ION

ChemComp-PO4:
PHOSPHATE ION

Source
  • homo sapiens (human)
KeywordsHYDROLASE / HIGH KM 5-PRIME NUCLEOTIDASE / CN-II / NUCLEOTIDE-BINDING / PHOSPHOPROTEIN / HYDROLASE-HYDROLASE EFFECTOR COMPLEX / complex

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