메뉴 건너뛰기




Volumn 77, Issue 4, 1999, Pages 2075-2089

Structure of dipalmitoylphosphatidylcholine/cholesterol bilayer at low and high cholesterol concentrations: Molecular dynamics simulation

Author keywords

[No Author keywords available]

Indexed keywords

CHOLESTEROL; DIPALMITOYLPHOSPHATIDYLCHOLINE;

EID: 0032863720     PISSN: 00063495     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0006-3495(99)77049-9     Document Type: Article
Times cited : (264)

References (48)
  • 1
    • 0026767199 scopus 로고
    • Lateral diffusion in the liquid phases of dimyristoylphosphatidylcholine/ cholesterol lipid bilayers: A free volume analysis
    • Almeida, P. F. F., W. L. C. Vaz, and T. E. Thompson. 1992. Lateral diffusion in the liquid phases of dimyristoylphosphatidylcholine/ cholesterol lipid bilayers: a free volume analysis. Biochemistry. 31: 6739-6747.
    • (1992) Biochemistry , vol.31 , pp. 6739-6747
    • Almeida, P.F.F.1    Vaz, W.L.C.2    Thompson, T.E.3
  • 2
    • 0030999097 scopus 로고    scopus 로고
    • Molecular dynamics simulations of a fluid bilayer of dipalmitoylphosphatidylcholine at full hydration, constant pressure, and constant temperature
    • Berger, O., O. Edholm, and F. Jähnig. 1997. Molecular dynamics simulations of a fluid bilayer of dipalmitoylphosphatidylcholine at full hydration, constant pressure, and constant temperature. Biophys. J. 72: 2002-2013.
    • (1997) Biophys. J. , vol.72 , pp. 2002-2013
    • Berger, O.1    Edholm, O.2    Jähnig, F.3
  • 3
    • 0028131711 scopus 로고
    • Evidence for regular distribution of sterols in liquid crystalline phosphatidylcholine bilayers
    • Chong, P. L. G. 1994. Evidence for regular distribution of sterols in liquid crystalline phosphatidylcholine bilayers. Proc. Natl. Acad. Sci. USA. 91:10069-10073.
    • (1994) Proc. Natl. Acad. Sci. USA , vol.91 , pp. 10069-10073
    • Chong, P.L.G.1
  • 4
    • 37049100766 scopus 로고
    • Cholesterol myristate: Structures of the crystalline solid and mesophases
    • Craven, B. M., and G. T. DeTitta. 1976. Cholesterol myristate: structures of the crystalline solid and mesophases. J. Chem. Soc. Perkin Trans. 2. 814-822.
    • (1976) J. Chem. Soc. Perkin Trans. 2 , pp. 814-822
    • Craven, B.M.1    DeTitta, G.T.2
  • 5
    • 0012558164 scopus 로고    scopus 로고
    • On the relationship between C-C and C-D order parameters and its use for studying the conformation of lipid acyl chains in biomembranes
    • Douliez, J. P., A. Ferrarini, and E. J. Dufourc. 1998. On the relationship between C-C and C-D order parameters and its use for studying the conformation of lipid acyl chains in biomembranes. J. Chem. Phys. 109:2513-2518.
    • (1998) J. Chem. Phys. , vol.109 , pp. 2513-2518
    • Douliez, J.P.1    Ferrarini, A.2    Dufourc, E.J.3
  • 6
    • 0028929692 scopus 로고
    • Restatement of order parameter in biomembranes: Calculation of C-C bond order parameters from C-D quadrupolar splittings
    • Douliez, J. P., A. Léonard, and E. J. Dufourc. 1995. Restatement of order parameter in biomembranes: calculation of C-C bond order parameters from C-D quadrupolar splittings. Biophys. J. 68:1727-1739.
    • (1995) Biophys. J. , vol.68 , pp. 1727-1739
    • Douliez, J.P.1    Léonard, A.2    Dufourc, E.J.3
  • 8
    • 0001563901 scopus 로고
    • Molecular-dynamics simulation of a smectic liquid crystal with atomic detail
    • Egberts, E., and H. J. C. Berendsen. 1988. Molecular-dynamics simulation of a smectic liquid crystal with atomic detail. J. Chem. Phys. 89: 3718-3732.
    • (1988) J. Chem. Phys. , vol.89 , pp. 3718-3732
    • Egberts, E.1    Berendsen, H.J.C.2
  • 9
    • 0028258175 scopus 로고
    • Molecular dynamics simulation of phospholipid membrane
    • Egberts, E., S. J. Marrink, and H. J. C. Berendsen. 1994. Molecular dynamics simulation of phospholipid membrane. Eur. Biophys. J. 22: 423-436.
    • (1994) Eur. Biophys. J. , vol.22 , pp. 423-436
    • Egberts, E.1    Marrink, S.J.2    Berendsen, H.J.C.3
  • 10
    • 0015501045 scopus 로고
    • The planar organization of lecithin-cholesterol bilayers
    • Engelman, D. M., and J. E. Rothman. 1972. The planar organization of lecithin-cholesterol bilayers. J. Biol. Chem. 247:3694-3697.
    • (1972) J. Biol. Chem. , vol.247 , pp. 3694-3697
    • Engelman, D.M.1    Rothman, J.E.2
  • 12
    • 33751154923 scopus 로고    scopus 로고
    • Comparison of structures of dimyrstoylphosphatidylcholine in the presence and absence of cholesterol by molecular dynamics simulation
    • Gabdouline, R. R., G. Vanderkooi, and C. Zheng. 1996. Comparison of structures of dimyrstoylphosphatidylcholine in the presence and absence of cholesterol by molecular dynamics simulation. J. Phys. Chem. 96: 15942-15946.
    • (1996) J. Phys. Chem. , vol.96 , pp. 15942-15946
    • Gabdouline, R.R.1    Vanderkooi, G.2    Zheng, C.3
  • 13
    • 0028909941 scopus 로고
    • New approach to study fast and slow motions in lipid bilayers: Application to dimyrstoylphosphatidylcholine-cholesterol interactions
    • Guerneve, C. L., and M. Auger. 1995. New approach to study fast and slow motions in lipid bilayers: application to dimyrstoylphosphatidylcholine-cholesterol interactions. Biophys. J. 68:1952-1959.
    • (1995) Biophys. J. , vol.68 , pp. 1952-1959
    • Guerneve, C.L.1    Auger, M.2
  • 14
    • 0019882643 scopus 로고
    • Preferred conformation and molecular packing of phosphatidylethanolamine and phosphatidylcholine
    • Hauser, H., I. Pasher, R. H. Pearson, and S. Sundell. 1981. Preferred conformation and molecular packing of phosphatidylethanolamine and phosphatidylcholine. Biochim. Biophys. Acta. 650:21-51.
    • (1981) Biochim. Biophys. Acta , vol.650 , pp. 21-51
    • Hauser, H.1    Pasher, I.2    Pearson, R.H.3    Sundell, S.4
  • 15
    • 0025017861 scopus 로고
    • Organization and interaction of cholesterol and phosphatidylcholine in model bilayer membranes
    • Hyslop, P. A., B. Morel, and R. D. Sauerheber. 1990. Organization and interaction of cholesterol and phosphatidylcholine in model bilayer membranes. Biochemistry. 29:1025-1038.
    • (1990) Biochemistry , vol.29 , pp. 1025-1038
    • Hyslop, P.A.1    Morel, B.2    Sauerheber, R.D.3
  • 16
    • 0025269179 scopus 로고
    • Relationship between lipid membrane area, hydrophobic thickness, and acyl-chain orientational order
    • Ipsen, J. H., O. G. Mouritsen, and M. Bloom. 1990. Relationship between lipid membrane area, hydrophobic thickness, and acyl-chain orientational order. Biophys. J. 57:405-412.
    • (1990) Biophys. J. , vol.57 , pp. 405-412
    • Ipsen, J.H.1    Mouritsen, O.G.2    Bloom, M.3
  • 18
    • 0023054740 scopus 로고
    • Deuterium NMR spectroscopy study of the fluorescent probe DPH in model membrane systems
    • Kintanar, A., A. C. Kunwar, and E. Oldfield, 1986. Deuterium NMR spectroscopy study of the fluorescent probe DPH in model membrane systems. Biochemistry. 25:6517-6524.
    • (1986) Biochemistry , vol.25 , pp. 6517-6524
    • Kintanar, A.1    Kunwar, A.C.2    Oldfield, E.3
  • 19
    • 0032946243 scopus 로고    scopus 로고
    • Cholesterol orientation and dynamics in dimyristoylphosphatidylcholine bilayers: A solid state deuterium NMR analysis
    • Marsan, M. P., I. Muller, C. Ramos, F. Rodriguez, E. J. Dufourc, J. Czaplicki, and A. Milon. 1999. Cholesterol orientation and dynamics in dimyristoylphosphatidylcholine bilayers: a solid state deuterium NMR analysis. Biophys. J. 76:351-359.
    • (1999) Biophys. J. , vol.76 , pp. 351-359
    • Marsan, M.P.1    Muller, I.2    Ramos, C.3    Rodriguez, F.4    Dufourc, E.J.5    Czaplicki, J.6    Milon, A.7
  • 20
    • 0024543281 scopus 로고
    • Cholesterol modifies the short-range repulsive interactions between phosphatidylcholine membranes
    • McIntosh, T. J., A. D. Magid, and S. A. Simon. 1989. Cholesterol modifies the short-range repulsive interactions between phosphatidylcholine membranes. Biochemistry. 28:17-25.
    • (1989) Biochemistry , vol.28 , pp. 17-25
    • McIntosh, T.J.1    Magid, A.D.2    Simon, S.A.3
  • 21
    • 0027506564 scopus 로고
    • Differential scanning calorimetric study of the effect of cholesterol on the thermotropic phase behavior of a homologous series of linear saturated phosphatidylcholines
    • McMullen, T. P. W., R. N. A. H. Lewis, and R. N. McElhaney. 1993. Differential scanning calorimetric study of the effect of cholesterol on the thermotropic phase behavior of a homologous series of linear saturated phosphatidylcholines. Biochemistry. 32:516-522.
    • (1993) Biochemistry , vol.32 , pp. 516-522
    • McMullen, T.P.W.1    Lewis, R.N.A.H.2    McElhaney, R.N.3
  • 23
    • 0025925265 scopus 로고
    • 2 rocking modes as quantitative infrared probes of one-, two-, and three-bond conformational disorder in dipalmitoylphosphatidylcholine and dipalmitoylphosphatidylcholine/cholesterol mixtures
    • 2 rocking modes as quantitative infrared probes of one-, two-, and three-bond conformational disorder in dipalmitoylphosphatidylcholine and dipalmitoylphosphatidylcholine/cholesterol mixtures. Biochemistry. 30:8558-8563.
    • (1991) Biochemistry , vol.30 , pp. 8558-8563
    • Mendelsohn, R.1    Davies, M.A.2    Chuster, H.F.3    Xu, Z.4    Bittman, R.5
  • 24
    • 0028837910 scopus 로고
    • Glycosphingolipid fatty acid arrangement in phospholipid bilayers: Cholesterol effects
    • Morrow, M. R., D. Singh, D. Lu, and C. W. M. Grant. 1995. Glycosphingolipid fatty acid arrangement in phospholipid bilayers: cholesterol effects. Biophys. J. 68:179-186.
    • (1995) Biophys. J. , vol.68 , pp. 179-186
    • Morrow, M.R.1    Singh, D.2    Lu, D.3    Grant, C.W.M.4
  • 25
    • 0017816466 scopus 로고
    • Spectroscopic studies of specifically deuterium labeled membrane systems. Nuclear magnetic resonance investigation of the effects of cholesterol in model systems
    • Oldfield, E., M. Meadows, D. Rice, and R. Jacobs. 1978. Spectroscopic studies of specifically deuterium labeled membrane systems. Nuclear magnetic resonance investigation of the effects of cholesterol in model systems. Biochemistry. 17:2727-2740.
    • (1978) Biochemistry , vol.17 , pp. 2727-2740
    • Oldfield, E.1    Meadows, M.2    Rice, D.3    Jacobs, R.4
  • 26
    • 0000065270 scopus 로고    scopus 로고
    • Hydrogen bonding of water to phosphatidylcholine in the membrane as studied by a molecular dynamics simulation: Location, geometry, and lipid-lipid bridging via hydrogen-bonded water
    • Pasenkiewicz-Gierula, M., Y. Takaoka, H. Miyagawa, K. Kitamura, and A. Kusumi. 1997. Hydrogen bonding of water to phosphatidylcholine in the membrane as studied by a molecular dynamics simulation: location, geometry, and lipid-lipid bridging via hydrogen-bonded water. J. Phys. Chem. 101:3677-3691.
    • (1997) J. Phys. Chem. , vol.101 , pp. 3677-3691
    • Pasenkiewicz-Gierula, M.1    Takaoka, Y.2    Miyagawa, H.3    Kitamura, K.4    Kusumi, A.5
  • 27
    • 0018788297 scopus 로고
    • The molecular structure of lecithin dihydrate
    • Pearson, R. H., and I. Pascher. 1979. The molecular structure of lecithin dihydrate. Nature. 281:499-501.
    • (1979) Nature , vol.281 , pp. 499-501
    • Pearson, R.H.1    Pascher, I.2
  • 28
    • 0026630705 scopus 로고
    • A molecular-dynamics study of the structure and dynamics of water between dilaurophosphatidylethanolamine bilayers
    • Raghavan, K., M. R. Reddy, and M. L. Berkowitz. 1992. A molecular-dynamics study of the structure and dynamics of water between dilaurophosphatidylethanolamine bilayers. Langmuir. 8:233-240.
    • (1992) Langmuir , vol.8 , pp. 233-240
    • Raghavan, K.1    Reddy, M.R.2    Berkowitz, M.L.3
  • 30
    • 0028835996 scopus 로고
    • Behavior of cholesterol and its effect on headgroup and chain conformations in lipid bilayers: A molecular dynamics study
    • Robinson, A. J., W. G. Richards, P. J. Thomas, and M. M. Hann. 1995. Behavior of cholesterol and its effect on headgroup and chain conformations in lipid bilayers: a molecular dynamics study. Biophys. J. 68:164-170.
    • (1995) Biophys. J. , vol.68 , pp. 164-170
    • Robinson, A.J.1    Richards, W.G.2    Thomas, P.J.3    Hann, M.M.4
  • 34
    • 5244326635 scopus 로고    scopus 로고
    • United atom AMBER force field for phospholipid membranes. Constant pressure molecular dynamics simulation of DPPC/water system
    • Smondyrev, A. M., and M. L. Berkowitz. 1999a. United atom AMBER force field for phospholipid membranes. Constant pressure molecular dynamics simulation of DPPC/water system. J. Comput. Chem. 20: 531-545.
    • (1999) J. Comput. Chem. , vol.20 , pp. 531-545
    • Smondyrev, A.M.1    Berkowitz, M.L.2
  • 35
    • 0000826117 scopus 로고    scopus 로고
    • Molecular dynamics study of Sn-1 and Sn-2 chain conformations in DPPC membranes
    • Smondyrev, A. M., and M. L. Berkowitz. 1999b. Molecular dynamics study of Sn-1 and Sn-2 chain conformations in DPPC membranes. J. Chem. Phys. 110:3981-3985.
    • (1999) J. Chem. Phys. , vol.110 , pp. 3981-3985
    • Smondyrev, A.M.1    Berkowitz, M.L.2
  • 36
    • 0032988825 scopus 로고    scopus 로고
    • Molecular dynamics simulation of DPPC bilayer in DMSO
    • Smondyrev, A. M., and M. L. Berkowitz. 1999c. Molecular dynamics simulation of DPPC bilayer in DMSO. Biophys. J. 76:2472-2478.
    • (1999) Biophys. J. , vol.76 , pp. 2472-2478
    • Smondyrev, A.M.1    Berkowitz, M.L.2
  • 37
    • 0031752966 scopus 로고    scopus 로고
    • Constant-pressure molecular dynamics investigation of cholesterol effects in a dipalmitoylphosphatidylcholine bilayer
    • Tu, K., M. L. Klein, and D. J. Tobias. 1998. Constant-pressure molecular dynamics investigation of cholesterol effects in a dipalmitoylphosphatidylcholine bilayer. Biophys. J. 75:2147-2156.
    • (1998) Biophys. J. , vol.75 , pp. 2147-2156
    • Tu, K.1    Klein, M.L.2    Tobias, D.J.3
  • 38
    • 0028867364 scopus 로고
    • Constant pressure and temperature molecular dynamics simulations of a fully hydrated liquid crystal phase dipalmitoylphosphatidylcholine bilayer
    • Tu, K., D. J. Tobias, and M. L. Klein. 1995. Constant pressure and temperature molecular dynamics simulations of a fully hydrated liquid crystal phase dipalmitoylphosphatidylcholine bilayer. Biophys. J. 69: 2558-2562.
    • (1995) Biophys. J. , vol.69 , pp. 2558-2562
    • Tu, K.1    Tobias, D.J.2    Klein, M.L.3
  • 39
    • 0030031374 scopus 로고    scopus 로고
    • Molecular dynamics investigation of the structure of a fully hydrated gel-phase dipalmitoylphosphatidylcholine bilayer
    • Tu, K., D. J. Tobias, and M. L. Klein. 1996. Molecular dynamics investigation of the structure of a fully hydrated gel-phase dipalmitoylphosphatidylcholine bilayer. Biophys. J. 70:595-608.
    • (1996) Biophys. J. , vol.70 , pp. 595-608
    • Tu, K.1    Tobias, D.J.2    Klein, M.L.3
  • 41
    • 0026331503 scopus 로고
    • Multibilayer structure of dimyristoylphosphatidylcholine dehydrate as determined by energy minimization
    • Vanderkooi, G. 1991. Multibilayer structure of dimyristoylphosphatidylcholine dehydrate as determined by energy minimization. Biochemistry. 30:10760-10768.
    • (1991) Biochemistry , vol.30 , pp. 10760-10768
    • Vanderkooi, G.1
  • 42
    • 0028293980 scopus 로고
    • Computation of mixed phosphatidylcholine-cholesterol bilayer structures by energy minimization
    • Vanderkooi, G. 1994. Computation of mixed phosphatidylcholine-cholesterol bilayer structures by energy minimization. Biophys. J. 66: 1457-1468.
    • (1994) Biophys. J. , vol.66 , pp. 1457-1468
    • Vanderkooi, G.1
  • 44
    • 0025128695 scopus 로고
    • Phase-equilibria of cholesterol dipalmitoylphosphatidylcholine mixtures: H-2 nuclear magnetic-resonance and differential scanning calorimetry
    • Vist, M. R., and J. H. Davis. 1990. Phase-equilibria of cholesterol dipalmitoylphosphatidylcholine mixtures: H-2 nuclear magnetic-resonance and differential scanning calorimetry. Biochemistry. 29:451-464.
    • (1990) Biochemistry , vol.29 , pp. 451-464
    • Vist, M.R.1    Davis, J.H.2
  • 45
    • 0032168391 scopus 로고    scopus 로고
    • Modulation of the binding of signal peptides to lipid bilayers by dipoles near the hydrocarbon-water interface
    • Voglino, L., T. J. McIntosh, and S. A. Simon. 1998. Modulation of the binding of signal peptides to lipid bilayers by dipoles near the hydrocarbon-water interface. Biochemistry. 37:12241-12252.
    • (1998) Biochemistry , vol.37 , pp. 12241-12252
    • Voglino, L.1    McIntosh, T.J.2    Simon, S.A.3
  • 47
    • 0001603906 scopus 로고
    • High-pressure infrared spectroscopic evidence of water binding sites in 1,2-diacyl phospholipids
    • Wong, P. T. T., and H. H. Mantsch. 1988. High-pressure infrared spectroscopic evidence of water binding sites in 1,2-diacyl phospholipids. Chem. Phys. Lipids. 46:213-224.
    • (1988) Chem. Phys. Lipids , vol.46 , pp. 213-224
    • Wong, P.T.T.1    Mantsch, H.H.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.