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TitleThe Antitumor Drug LB-100 Is a Catalytic Inhibitor of Protein Phosphatase 2A (PPP2CA) and 5 (PPP5C) Coordinating with the Active-Site Catalytic Metals in PPP5C.
Journal, issue, pagesMol. Cancer Ther., Vol. 18, Page 556-566, Year 2019
Publish dateJul 13, 2017 (structure data deposition date)
AuthorsD'Arcy, B.M. / Swingle, M.R. / Papke, C.M. / Abney, K.A. / Bouska, E.S. / Prakash, A. / Honkanen, R.E.
External linksMol. Cancer Ther. / PubMed:30679389
MethodsX-ray diffraction
Resolution1.65 Å
Structure data

PDB-5wg8:
Structure of PP5C with LB-100; 7-oxabicyclo[2.2.1]heptane-2,3-dicarbonyl moiety modeled in the density
Method: X-RAY DIFFRACTION / Resolution: 1.65 Å

Chemicals

ChemComp-MN:
Unknown entry

ChemComp-LB1:
(1S,2R,3S,4R)-3-(4-methylpiperazine-1-carbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

ChemComp-MPD:
(4S)-2-METHYL-2,4-PENTANEDIOL / precipitant*YM

ChemComp-MRD:
(4R)-2-METHYLPENTANE-2,4-DIOL / precipitant*YM

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE/HYDROLASE inhibitor / Hydrolase Inhibitor / HYDROLASE / HYDROLASE-HYDROLASE inhibitor complex

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