Simulation report
Technical information
General information
Name: Beta arrestin 1 - loop flexibility in solution
PDB id: 6U1N
Activation state: Active
Description: -
Submitted by: Tomasz Stepniewski, IMIM
System setup
Solvent type: Implicit
Membrane type: Implicit
Ionic composition: Sodium ion (157 mM), Chloride (159 mM)
Number of molecules:
Water: 52356
Chloride: 150
Sodium ion: 148
Beta-arrestin-1: 1
Total number of atoms: 163184
Simulation details
Software and version: Acemd, 3.3
Forcefield and version: Charmm, 36M
Time step : 4.0 fs
Delta : 1.0 ns
Replicates: 1
Accumulated simulation time: 1.5 µs
Additonal parameters: Available at "Simulation protocol & starting files"
References
None. None. Location-biased β-arrestin conformations direct G protein-coupled receptor signa. None. doi: spatiotemporalsignaling.
Find a list of all simulations published in this paper: 1526
