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TitleSynthesis, Pharmacology, and Biostructural Characterization of Novel Alpha(4)Beta(2) Nicotinic Acetylcholine Receptor Agonists.
Journal, issue, pagesJ. Med. Chem., Vol. 56, Page 940-, Year 2013
Publish dateNov 26, 2012 (structure data deposition date)
AuthorsUssing, C.A. / Hansen, C.P. / Petersen, J.G. / Jensen, A.A. / Rohde, L.A.H. / Ahring, P.K. / Nielsen, E.O. / Kastrup, J.S. / Gajhede, M. / Frolund, B. / Balle, T.
External linksJ. Med. Chem. / PubMed:23256554
MethodsX-ray diffraction
Resolution2.195 - 2.48 Å
Structure data

PDB-3zdg:
Crystal Structure of Ls-AChBP complexed with carbamoylcholine analogue 3-(dimethylamino)butyl dimethylcarbamate (DMABC)
Method: X-RAY DIFFRACTION / Resolution: 2.48 Å

PDB-3zdh:
Crystal structure of Ls-AChBP complexed with carbamoylcholine analogue N,N-dimethyl-4-(1-methyl-1H-imidazol-2-yloxy)butan-2-amine
Method: X-RAY DIFFRACTION / Resolution: 2.195 Å

Chemicals

ChemComp-XRX:
3-(dimethylamino)butyl dimethylcarbamate

ChemComp-SO4:
SULFATE ION

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

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER

ChemComp-1PE:
PENTAETHYLENE GLYCOL / precipitant*YM

ChemComp-HOH:
WATER

ChemComp-XRS:
(2R)-N,N-dimethyl-4-(1-methylimidazol-2-yl)oxy-butan-2-amine

Source
  • lymnaea stagnalis (great pond snail)
KeywordsACETYLCHOLINE-BINDING PROTEIN

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