In silico Alanine Scanning Mutagenesis for ligand binding site.

ABS-Scan performs alanaine scanning mutagenesis for a given protein-ligand complex. Binding site residues are determined through user-defined cut-off distance threshold and each of these residues are then mutated to alanine. The protein-ligand energetics is evaluated for each binding site alanine mutant generated. The protein-ligand interaction scores obtained are then compared with wild-type to evaluate the energetic contributions made by each residue in the binding site towards ligand recognition.

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  PDB ID:(Eg-1DHI)  Chain ID:(A-Z)


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Creative Commons License
ABS-Scan by Nagasuma Chandra is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.
Based on a work at