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. 2022 Sep 13;9:947203. doi: 10.3389/fmolb.2022.947203

TABLE 1.

Interaction of PES with P. falciparum Hsp70-1/PfHop as predicted in silico.

Protein Compound Binding energy (Kcal/mol) Hydrogen bonding and residues involved Hydrophobic interactions and residues involved
PfHop PES −7.3 Arg407 Met123, Leu124, Tyr 372, Ile373
PfHsp70-1 −6.9 Glu417, Gln454 Val451, Ile453