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. 2020 May 28;87:107292. doi: 10.1016/j.compbiolchem.2020.107292

Table 1.

Binding affinity calculated using molecular docking to the active site with QPLD in kcal/mol.

Protomer A Protomer B Structure
α-ketoamide 13b −8.7 −9.2 graphic file with name fx1_lrg.gif
Amoxicillin −5.0 −4.8 graphic file with name fx2_lrg.gif