Carbohydrate chains are ubiquitous in the complex molecular processes of life. These highly diverse chains are recognized by a variety of protein receptors, enabling glycans to regulate many biologica
aData generated by comparing the structure at 0 ns and 50 ns.bThe RMSD evolution along the time is available in Figure S14.cExcluding the polyproline tail, this value is reduced to 4.117.
We provide evidence supporting that protein–protein and protein–ligand docking poses are functions of protein shape and intrinsic dynamics. Over sets of 68 protein–protein complexes and 240 nonhomolog