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. Author manuscript; available in PMC: 2020 Oct 11.
Published in final edited form as: ACS Infect Dis. 2019 Aug 21;5(10):1772–1778. doi: 10.1021/acsinfecdis.9b00228

Table 1.

Interactions of Inhibitors with Eis Residues of Interest

Eis residue/ligand TOB inhibitor 1 inhibitor 2 inhibitor 3
 F24 hydrophobic ππ
 D26 salt bridge H-bond steric salt bridge
 W36 H-bond/steric ππ stacking ππ stacking ππ stacking
 R37 hydrophobic hydrophobic hydrophobic
 L63 hydrophobic hydrophobic hydrophobic
 M65 hydrophobic hydrophobic hydrophobic
 S83 H-bond steric steric steric
 F84 hydrophobic ππ stacking ππ stacking ππ stacking