From vkitzing#* at *#sunny.mpimf-heidelberg.mpg.de Fri Nov 24 08:37:23 1995 Received: from otto.mpimf-heidelberg.mpg.de for vkitzing(+ at +)sunny.mpimf-heidelberg.mpg.de by www.ccl.net (8.6.10/950822.1) id IAA19078; Fri, 24 Nov 1995 08:22:16 -0500 Received: from [192.109.43.34] (mac10.mpimf-heidelberg.mpg.de) by otto.mpimf-heidelberg.mpg.de (4.1/SMI-4.1) id AA16886; Fri, 24 Nov 95 14:20:45 +0100 Date: Fri, 24 Nov 95 14:20:45 +0100 Message-Id: <9511241320.AA16886 #at# otto.mpimf-heidelberg.mpg.de> To: toukie %-% at %-% zui.unizh.ch From: vkitzing*- at -*sunny.mpimf-heidelberg.mpg.de (Eberhard von Kitzing) Subject: Re: CCL:Two questions Cc: CHEMISTRY /at\www.ccl.net (Computational Chemistry List) Dear Prof. Shapiro, > (ii) Does anyone have any information on experimental (preferred) > or theoretical (OK) values for the dielectric constant in > the interior of lipid bilayers, artificial membranes, or > (preferred) biological membranes? There is no simple answer to this question. In the experimental as well as in the theoretical case the answer depends on what property you are concentrating. Membranes, especially biological ones, are highly inhomogeneous. Thismeans that the local dielectric constant does vary from place to place (perhaps in the range between 2.5 for hydrocarbones to 6 for more polarizable materials). The situation get more complicated if you consider the effective dielectric constant, a measure of the screening of two charges due to the presence of the dielectric properties of water and the membrane. In this case, the value cannot be lower than the membrane dielectric constant but can become large than the water dielectric constant. This problem has been considered for estimating the energy barriers for ions permeating through ion channels. For this problem there exists a huge amount of literature (see below). In these studies, however, the effect of the electrolyte has often been neglected. Counter ions always increase the charge-charge screening. %0 Journal Article %A Parsegian, V. Adrian %D 1969 %T Energy of an Ion crossing a Low Dielectric Membrane: Solutions to Four Relevant Electrostatic Problems %J Nature %V 221 %P 844-846 %K continuum theory, dielectric constant, membrane, ion channels, ion carriers, mirror image, image charge, image force %X The influences on ion energy of membrane thickness, ion-pair formation, pores, and carriers have been estimated. Only pores and carriers lower the energy barrier significantly %0 Journal Article %A Parsegian, V. Adrian %D 1975 %T Ion-Membrane interactions a structural forces %J Annals of the New York Academy of Sciences %V 264 %P 161-174 %K continuum theory, dielectric constant, membrane, ion channels, ion carriers, mirror image, image charge, image force %0 Book Section %A Jordan, Peter C. %D 1993 %T Interactions of ions with membrane proteins %B Thermodynamics of Membrane Receptors and Channels %E Jackson, Meyer B. %I CRC Press %C Boca Raton %P 27-80 %K continuum model, effective dielectric constant, Born energy, Eyring theory, Nernst-Planck equation, energy profiles, gramicidine, ionic strength effects, conductivity, alamethicin, acetylcholin receptor channel, voltage gated channels, anion channels %0 Journal Article %A Partenskii, Michael B. %A Dorman, Vladimir %A Jordan, Peter C. %D 1994 %T Influence of a channel-forming peptide on energy barriers to ion permeation, viewed from a continuum dielectric perspective %J Biophysical Journal %V 67 %N 4 %P 1429-1438 %K ** gramicidin channel; dynamics; water; model; electrostatics; simulations; movement; constant; membrane electrostatic barrier; electrostatic screening; ion transport; ionic conductivity; dielectric screening %0 Journal Article %A Zhou, F. %A Schulten, K. %D 1995 %T Molecular-dynamics study of a membrane water interface %J Journal of Physical Chemistry %V 99 %N 7 %P 2194-2207 %F Review %K ** lipid bilayer-membranes; hydration forces; phospholipid-bilayers; computer-simulation; dilauroylphosphatidylethanolamine bilayers; electrostatic interactions; amphiphilic surfaces; dielectric-constant; boundary-conditions; magnetic-resonance; ------------------------------------------------------------------------- Eberhard von Kitzing Max-Planck-Institut fuer Medizinische Forschung Jahnstr. 29, D69120 Heidelberg, FRG Carl-Zuckmayer Str. 17, D69126 Heidelberg (privat) FAX : +49-6221-486 459 (work) Tel.: +49-6221-486 467 (work) Tel.: +49-6221-385 129 (home) internet: vkitzing:~at~:sunny.MPImF-Heidelberg.mpg.de http://sunny.mpimf-heidelberg.mpg.de/people/vkitzing/Eberhard.html