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TitleGeneration of candidate ligands for nicotinic acetylcholine receptors via in situ click chemistry with a soluble acetylcholine binding protein template.
Journal, issue, pagesJ. Am. Chem. Soc., Vol. 134, Page 6732-6740, Year 2012
Publish dateJan 16, 2012 (structure data deposition date)
AuthorsGrimster, N.P. / Stump, B. / Fotsing, J.R. / Weide, T. / Talley, T.T. / Yamauchi, J.G. / Nemecz, A. / Kim, C. / Ho, K.Y. / Sharpless, K.B. ...Grimster, N.P. / Stump, B. / Fotsing, J.R. / Weide, T. / Talley, T.T. / Yamauchi, J.G. / Nemecz, A. / Kim, C. / Ho, K.Y. / Sharpless, K.B. / Taylor, P. / Fokin, V.V.
External linksJ. Am. Chem. Soc. / PubMed:22394239
MethodsX-ray diffraction
Resolution2.3 Å
Structure data

PDB-4dbm:
Aplysia californica-AChBP in complex with triazole 18
Method: X-RAY DIFFRACTION / Resolution: 2.3 Å

Chemicals

ChemComp-NAG:
2-acetamido-2-deoxy-beta-D-glucopyranose

ChemComp-0J0:
(3-exo)-8,8-dimethyl-3-(4-{[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]methyl}-1H-1,2,3-triazol-1-yl)-8-azoniabicyclo[3.2.1]octane

ChemComp-HOH:
WATER

Source
  • aplysia californica (California sea hare)
KeywordsACETYLCHOLINE-BINDING PROTEIN / In situ click-chemistry / AChBP / Nicotinic / triazole / tropane / quinolinone / Cys-loop Receptor homologue

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