Multiresolution molecular dynamics simulations reveal the interplay between conformational variability and functional interactions in membrane-bound cytochrome 2B4

This dataset contains coordinate files, scripts and input parameters to run and analyse molecular dynamics simulations of membrane bound CYP 2B4. The associated study is described in: data - containes input data & last simulation frames for all of the described MD simulations and analyses described in the manuscript Structures_used_for_figures - contains .pdb and .pse files of all protein structures depicted in the manuscript