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. 2016 Dec 21;6:39637. doi: 10.1038/srep39637

Table 1. Details of docked complex of CviR receptor protein with natural ligand and compound cyclo(Trp-Ser).

Molecules Binding Energy (kcal/mol) Hydrogen bonding interactions Key Hydrophobic interactions
Natural ligind (C6HSL) −6.86 Asp97, Trp84, Tyr80, Ser155 Leu100, Leu85, Ile99, Tyr88, Trp111, Phe126, Trp111, Phe126, Tyr80
Cyclo(Trp-Ser) −8.68 Asp97, Trp84, Tyr88 Leu57, Val75, Leu100, Phe115