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. 2021 May 28;8:655035. doi: 10.3389/fmolb.2021.655035

TABLE 6.

Per-residue energy contribution of five key residues obtained through ANCHOR analysis for equilibrated simulation trajectory of C-Raf/RKIP structural complex.

C-raf RKIP
Residues Binding free energy (kcal/mol) Residues Binding free energy (kcal/mol)
Arg398 −12.8 Lys80 −15.9
Lys399 −9.9 Gly186 −12.1
Glu345 −8.9 Glu182 −10.4
Glu348 −6.4 Lys148 −1.6
Tyr340 −5.8 Tyr181 −1.4

*Majorly contributing residues highlighted in bold.