Published June 17, 2019
| Version v1
Dataset
Open
Simulation CER160_1_POPC_512_NaCl_150mM_310K (8 replicas)
Authors/Creators
- 1. Institute of Organic Chemistry and Biochemistry of the Czech Academy of Sciences
Description
Title publication: A Ceramide-Regulated Element in the Late Endosomal Protein LAPTM4B Controls Amino Acid Transporter Interaction
Year publication: 2018
DOI publication: 10.1021/acscentsci.7b00582
Description: Simulation POPC membrane containing 1 ceramide (CER160) originally in the water phase using charmm36 at 310K.
MD engine: gromacs 5.0.5-dev-20150319-0bec922
Force field: charmm36
Temperature: 310 K
Pressure: 1 bar
Simulation time: 200 ns per replica
Saving frequency: 100 ps
Molecular content:
POPC 512
CER160 1
SOL 34258
NA 92
CL 92
Additional information:
* Membrane containing LAPTM4B TM3 peptides.
Files
Files
(12.8 GB)
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md5:71a93cc32eef53050f82422898d0cab9
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md5:6d28531e209a39cb4f73b5ef374e3a18
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md5:05be1ce9e0308cb21ac1227fa3279f4d
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1.3 GB | Download |