Published August 28, 2020 | Version v1
Journal article Open

N-glycosylation blocks and fosters different receptor-ligand binding sites: the chameleonic CD44–hyaluronan interaction - simulation set B3

  • 1. University of Helsinki
  • 2. Institute of Molecular Genetics of the Czech Academy of Sciences
  • 3. Institute of Organic Chemistry and Biochemistry of the Czech Academy of Sciences

Description

N-glycosylation blocks and fosters different receptor-ligand binding sites: the chameleonic CD44–hyaluronan interaction

Simulation files (GROMACS 4.6 format) and structures for the system B3 simulations.

Files include:

-initial structures (.pdb), 
-run input files (.tpr)
-simulation parameter files (.mdp)
-system topology file (.top)
-topology files included in the system topology file (.itp)

Files

Files (558.1 MB)

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md5:df68d70caab46d69c091b94538510aa6
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md5:c83e59ad59f91afcb5e6c18bf91656b1
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