Molecular electrometer and binding of cations to phospholipid bilayers

Author:

Catte Andrea1234,Girych Mykhailo5678,Javanainen Matti9101189,Loison Claire1213141516,Melcr Josef1718192021,Miettinen Markus S.2223242526,Monticelli Luca271516ORCID,Määttä Jukka28678,Oganesyan Vasily S.1234,Ollila O. H. Samuli5678,Tynkkynen Joona910118,Vilov Sergey1213141516

Affiliation:

1. School of Chemistry

2. University of East Anglia

3. Norwich

4. UK

5. Department of Neuroscience and Biomedical Engineering

6. Aalto University

7. Espoo

8. Finland

9. Department of Physics

10. Tampere University of Technology

11. Tampere

12. Univ Lyon, Université Claude Bernard Lyon 1

13. CNRS

14. Institut Lumiére Matiére

15. LYON

16. France

17. Institute of Organic Chemistry and Biochemistry

18. Czech Academy of Sciences

19. 16610 Prague 6

20. Czech Republic

21. Charles University in Prague

22. Fachbereich Physik

23. Freie Universität Berlin

24. Berlin

25. Germany

26. Max Planck Institute of Colloids and Interfaces

27. Institut de Biologie et Chimie des Protéines (IBCP)

28. Department of Chemistry

Abstract

The molecular electrometer – reorientation of lipid head due to bound charge – allows direct quantitative vetting of simulations against noninvasive NMR experiments; most simulation models overestimated lipid–cation affinities.

Funder

Institut national de la santé et de la recherche médicale

Emil Aaltosen Säätiö

Volkswagen Foundation

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

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