Stability and dynamics of virus capsids described by coarse-grained modeling

被引:200
作者
Arkhipov, Anton
Freddolino, Peter L.
Schulten, Klaus [1 ]
机构
[1] Univ Illinois, Beckman Inst Adv Sci & Technol, Urbana, IL 61801 USA
[2] Univ Illinois, Dept Phys, Urbana, IL 61801 USA
[3] Univ Illinois, Ctr Biophys & Computat Biol, Urbana, IL 61801 USA
关键词
D O I
10.1016/j.str.2006.10.003
中图分类号
Q5 [生物化学]; Q7 [分子生物学];
学科分类号
071010 ; 081704 ;
摘要
We report a study of the structural dynamics of viral capsids, simulated on a microsecond timescale, by employing a coarse-graining molecular dynamics method. The method was calibrated against an all-atom simulation of one complete virus. Among the studied capsids, some collapsed rapidly, while others were found to be stable. Interlocking between coat proteins is found to be a key factor determining the stability of the capsids.
引用
收藏
页码:1767 / 1777
页数:11
相关论文
共 68 条
[1]  
[Anonymous], 1996, Fields virology
[2]   Investigation of viral DNA packaging using molecular mechanics models [J].
Arsuaga, J ;
Tan, RKZ ;
Vazquez, M ;
Sumners, DW ;
Harvey, SC .
BIOPHYSICAL CHEMISTRY, 2002, 101 :475-484
[3]  
Bahar I, 1997, PROTEINS, V29, P292, DOI 10.1002/(SICI)1097-0134(199711)29:3<292::AID-PROT4>3.0.CO
[4]  
2-D
[5]   What does structure tell us about virus evolution? [J].
Bamford, DH ;
Grimes, JM ;
Stuart, DI .
CURRENT OPINION IN STRUCTURAL BIOLOGY, 2005, 15 (06) :655-663
[6]   Structural comparison of the plant satellite viruses [J].
Ban, N ;
Larson, SB ;
McPherson, A .
VIROLOGY, 1995, 214 (02) :571-583
[7]   THE STRUCTURE OF SATELLITE PANICUM MOSAIC-VIRUS AT 1.9 ANGSTROM RESOLUTION [J].
BAN, N ;
MCPHERSON, A .
NATURE STRUCTURAL BIOLOGY, 1995, 2 (10) :882-890
[8]   A STUDY OF SELF-ASSEMBLY PROCESS IN A SMALL SPHERICAL VIRUS - FORMATION OF ORGANIZED STRUCTURES FROM PROTEIN SUBUNITS IN VITRO [J].
BANCROFT, JB ;
HILLS, GJ ;
MARKHAM, R .
VIROLOGY, 1967, 31 (02) :354-&
[9]   Insertion and assembly of membrane proteins via simulation [J].
Bond, PJ ;
Sansom, MSP .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2006, 128 (08) :2697-2704
[10]   PHYSICAL PRINCIPLES IN CONSTRUCTION OF REGULAR VIRUSES [J].
CASPAR, DLD ;
KLUG, A .
COLD SPRING HARBOR SYMPOSIA ON QUANTITATIVE BIOLOGY, 1962, 27 :1-&