Published September 21, 2018 | Version v1

Simulation CER160_9_POPC_512_TM3_10_5up_5down_NaCl_150mM_310K (rep1)

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: 2134 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

Files (14.2 GB)

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md5:b13b8c1f5e589eb4f324e3871a3788f7
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659 Bytes Download
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5.2 MB Download
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14.1 GB Download
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Additional details

Related works

Is supplement to
10.1021/acscentsci.7b00582 (DOI)