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Structure paper

TitleTargeting inactive enzyme conformation: aryl diketoacid derivatives as a new class of PTP1B inhibitors.
Journal, issue, pagesJ. Am. Chem. Soc., Vol. 130, Page 17075-17084, Year 2008
Publish dateAug 26, 2008 (structure data deposition date)
AuthorsLiu, S. / Zeng, L.F. / Wu, L. / Yu, X. / Xue, T. / Gunawan, A.M. / Long, Y.Q. / Zhang, Z.Y.
External linksJ. Am. Chem. Soc. / PubMed:19012396
MethodsX-ray diffraction
Resolution1.9 - 2.4 Å
Structure data

PDB-3eax:
Crystal structure PTP1B complex with small molecule compound LZP-6
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-3eb1:
Crystal structure PTP1B complex with small molecule inhibitor LZP-25
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

Chemicals

ChemComp-LZP:
4,4'-piperazine-1,4-diylbis{1-[3-(benzyloxy)phenyl]-4-oxobutane-1,3-dione}

ChemComp-HOH:
WATER

ChemComp-LZQ:
4-[3-(dibenzylamino)phenyl]-2,4-dioxobutanoic acid

Source
  • homo sapiens (human)
KeywordsHYDROLASE / protein tyrosine phosphatase / PTP1B / inhibitor / Acetylation / Endoplasmic reticulum / Membrane / Oxidation / Phosphoprotein / Polymorphism / Protein phosphatase

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