Published July 11, 2024 | Version v2
Dataset Open

The conformational plasticity of structurally unrelated lipid transport proteins correlates with their mode of action

Creators

  • 1. University of Fribourg
  • 2. Universidad de Oviedo
  • 3. ROR icon École Polytechnique Fédérale de Lausanne
  • 4. ROR icon University of Zurich
  • 5. ROR icon University Hospital of Zurich

Description

Supporting DATA files for "Conformational plasticity of structurally unrelated lipid transport proteins correlates with their mode of action".

  1. zenodo_simulation_starting_files_and_result_pdbs.zip contains input files for atomistic and coarse-grained MD simulations, membrane binding interface results from coarse-grained simulations, and apo-like and holo-like conformations of lipid transfer domains arising from clustering of atomistic simulations
  2. zenodo_data_and_codes.zip contains the raw data and/or scripts used for the analysis of the figures of the paper as well as a README file explaining the contents. The figure caption in the manuscript indicates the folder name that contains data relevant to that particular figure. 

    The trajectories have not been uploaded here, in case you are interested, please ask the corresponding author (stefano.vanni@unifr.ch).

 

Files

zenodo_data_and_codes.zip

Files (89.5 MB)

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md5:5c93fea1913aabceee3d16322a4ec24f
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md5:f7214c82359584d72c30e27de5aa6390
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