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. 2021 Oct 5;297(5):101271. doi: 10.1016/j.jbc.2021.101271

Table 3.

Comparison of computed binding constants across two ligands

Ligand/protein system ΔGsim0(Kcal/mol) Kon (M−1s−1) Koff (s−1)
LacNAc/Galectin −3.8 2.8 × 108 1 × 106
LacNAc derivative/Galectin −5.70 1.4 × 108 0.038 × 106