Membranes


N.B.: If you use the following files in your work, please cite the primary source. (see Description field)

Name:yeast t1
Lipids: DYPC, PYPI, POPI, YOPC, ERGO, DYPE, YOPE, POPS, POPA, PYPE
Forcefield: charmm36
Software:Namd 2
Files: LIM5_yeast_t1.pdb, LIM5_yeast_t1.txt
Parameters and other files
supplementary/
supplementary/t1.psf
supplementary/t1.xplor.psf
supplementary/t1-200ns.pdb
supplementary/README
Simulation files
Number:300 lipids
Temperature:303 °K
Equilibration:200 ns
Tags:saccharomyces cerevisiae, yeast, trans golgi network
Proteins:
Description:

Primary source: http://terpconnect.umd.edu/~jbklauda/memb.html

ERG residues have been renamed ERGO.

References: Monje-Galvan2015 Biochemistry, 54. Modeling Yeast Organelle Membranes and How Lipid Diversity Influences Bilayer Properties
Composition:
Upper leaflet 1
29 DYPC (Klauda2010) ( 19.3%)
28 PYPI (Wu2014) ( 18.7%)
27 POPI (Wu2014) ( 18.0%)
23 YOPC (Klauda2010) ( 15.3%)
18 ERGO (Lim2012) ( 12.0%)
6 DYPE (Klauda2010) ( 4.0%)
6 YOPE (Klauda2010) ( 4.0%)
5 POPS (Venable2013) ( 3.3%)
4 POPA (Klauda2010) ( 2.7%)
4 PYPE (Klauda2010) ( 2.7%)
Lower leaflet 1
29 DYPC (Klauda2010) ( 19.3%)
28 PYPI (Wu2014) ( 18.7%)
27 POPI (Wu2014) ( 18.0%)
23 YOPC (Klauda2010) ( 15.3%)
18 ERGO (Lim2012) ( 12.0%)
6 DYPE (Klauda2010) ( 4.0%)
6 YOPE (Klauda2010) ( 4.0%)
5 POPS (Venable2013) ( 3.3%)
4 POPA (Klauda2010) ( 2.7%)
4 PYPE (Klauda2010) ( 2.7%)
Curator: Jean-Marc Crowet on Dec. 9, 2020

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