Published September 21, 2018
| Version v1
Dataset
Open
Simulation CER160_9_POPC_512_TM3_10_5up_5down_NaCl_150mM_310K (rep2)
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 ten LAPTM4B-TM3 peptides and 9 ceramide (CER160) originally in the water phase using charmm36 at 310K.
MD engine: 2016.2-dev-20170105-4feb0be
Force field: charmm36
Temperature: 310 K
Pressure: 1 bar
Simulation time: 4583 ns
Saving frequency: 100 ps
Molecular content:
TM3 10
POPC 512
CER160 9
SOL 34248
NA 102
CL 92
Additional information:
* Membrane containing LAPTM4B TM3 peptides.
Files
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(30.5 GB)
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Additional details
Related works
- Is supplement to
- 10.1021/acscentsci.7b00582 (DOI)