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Structure paper

TitlePotent small-molecule binding to a dynamic hot spot on IL-2.
Journal, issue, pagesJ. Am. Chem. Soc., Vol. 125, Page 15280-15281, Year 2003
Publish dateJun 30, 2003 (structure data deposition date)
AuthorsThanos, C.D. / Randal, M. / Wells, J.A.
External linksJ. Am. Chem. Soc. / PubMed:14664558
MethodsX-ray diffraction
Resolution2.6 - 2.8 Å
Structure data

PDB-1pw6:
Low Micromolar Small Molecule Inhibitor of IL-2
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

PDB-1py2:
Structure of a 60 nM Small Molecule Bound to a Hot Spot on IL-2
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

Chemicals

ChemComp-SO4:
SULFATE ION

ChemComp-FRB:
2-CYCLOHEXYL-N-(2-{4-[5-(2,3-DICHLORO-PHENYL)-2H-PYRAZOL-3-YL]-PIPERIDIN-1-YL}-2-OXO-ETHYL)-2-GUANIDINO-ACETAMIDE

ChemComp-FRH:
5-[2,3-DICHLORO-4-(5-{1-[2-(2-GUANIDINO-4-METHYL-PENTANOYLAMINO)-ACETYL]-PIPERIDIN-4-YL}-1-METHYL-1H-PYRAZOL-3-YL)-PHENOXYMETHYL]-FURAN-2-CARBOXYLIC ACID

ChemComp-ZN:
Unknown entry

Source
  • homo sapiens (human)
KeywordsIMMUNE SYSTEM / IL-2 interleukin 2 small molecule inhibitor / IL-2 / interleukin 2 / small molecule / hot spot / molecular recognition

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