Published June 9, 2019
| Version v1
Dataset
Open
A structural model of the human serotonin transporter in an outward-occluded state: MD simulation data
Description
The uploads contain relevant data to supplement the study https://www.biorxiv.org/content/10.1101/637009v1, where the details of the methods are described.
charmm_energy_minimization.inp is the input file that was used to run an energy minimization on structural models
The two archives contain relevant MD simulation data in coordinate, parameter and trajectory files:
hSERT_Ce.tar.gz outward-open X-ray structure PDB 5I71
hSERT_Ceo.tar.gz outward-occluded structural model
Files
Files
(22.4 GB)
| Name | Size | Download all |
|---|---|---|
|
md5:faa50a0ecefb644b12bf9ce4fd674675
|
16.0 kB | Download |
|
md5:39cf1b55df973366964e4bf081f1e477
|
11.9 GB | Download |
|
md5:5fba3007c8b1904aacf355c8077460da
|
10.5 GB | Download |
Additional details
Related works
- Is supplement to
- 10.1101/637009 (Handle)
Funding
- Molecular Drug Targets W 1232
- FWF Austrian Science Fund