SlimMD Database
P2Y1 purinergic receptor in the presence of 10% of phenol (PHX) 40 ns
Category: Protein-Membrane
Downloaded: 403
| Total length of simulation: | 40 ns | Simulation software: | NAMD |
| Time between snapshots: | 200 ps | MD forcefield: | CHARMM36, CgenFF |
| File formats: | dcd, psf, pdb | ||
| Simulation details: | Probe MD simulations. Mapping an allosteric site at the lipid interface of the P2Y1 purinergic receptor. The P2Y1 receptor in the presence of 10% of phenol (PHX) in the water-POPC bilayer. 0.15M of Na+ and Cl-. Three replicates are provided. | ||
| Trajectory donated by: | Irina Tikhonova | ||
| Citations: | https://doi.org/10.1021/acscentsci.1c00802 | ||
