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. 2019 Nov 8;20(22):5574. doi: 10.3390/ijms20225574

Figure 8.

Figure 8

Per residue average L and average BC difference calculated between ligand-free and SANC190-bound systems (run1 and run2 on average). Top panel: Residues governing protein-ligand affinity; middle panel: Per residue average L difference; bottom panel: Per residue average BC difference.