Login / Signup

An Artificial Molecular Shuttle Operates in Lipid Bilayers for Ion Transport.

Sujun ChenYichuan WangTing NieChunyan BaoChenxi WangTianyi XuQiuning LinDa-Hui QuXue-Qing GongYi YangLinyong ZhuHe Tian
Published in: Journal of the American Chemical Society (2018)
Inspired by natural biomolecular machines, synthetic molecular-level machines have been proven to perform well-defined mechanical tasks and measurable work. To mimic the function of channel proteins, we herein report the development of a synthetic molecular shuttle, [2]rotaxane 3, as a unimolecular vehicle that can be inserted into lipid bilayers to perform passive ion transport through its stochastic shuttling motion. The [2]rotaxane molecular shuttle is composed of an amphiphilic molecular thread with three binding stations, which is interlocked in a macrocycle wheel component that tethers a K+ carrier. The structural characteristics enable the rotaxane to transport ions across the lipid bilayers, similar to a cable car, transporting K+ with an EC50 value of 1.0 μM (3.0 mol % relative to lipid). We expect that this simple molecular machine will provide new opportunities for developing more effective and selective ion transporters.
Keyphrases
  • single molecule
  • molecular dynamics simulations
  • deep learning
  • machine learning
  • quantum dots