Complex Ligand InteractionWeb (Generated using Maestro9.2)
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The image below, generated by a molecular visualizer, shows us how tedious it is to visualize and analyze the interactions of a particular ligand with its surrounding residues in a specific docked pose.
Thus, ReSite focuses on reporting all the amino acid residues present in the active site, for every docked pose, that are presumed to be involved in the ligand interactions, based on a parameter of distance constraint.
Thus, ReSite focuses on reporting all the amino acid residues present in the active site, for every docked pose, that are presumed to be involved in the ligand interactions, based on a parameter of distance constraint.
Most of the interactions occur within a distance of 3-10 angstroms between the docked ligand and the respective amino acid residues of the active site. ReSite utilises this above stated range while stating the distance constraint parameter as a user input to define the surrounding residues.
A Tool for analysis of the active site residues in protein-ligand interactions
