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Table 3 Molecular docking results of target and ligands

From: Antibacterial activity of oregano essential oils against Streptococcus mutans in vitro and analysis of active components

Ligands

Docking score (Kcal/mol)

 

GtfB

GtfC

GtfD

VicR

SpaP

GbpB

BrpA

RelA

carvacrol

-6.0

-6.0

-5.8

-4.9

-5.2

-6.0

-6.4

-4.8

γ-terpinene

-5.6

-5.6

-5.5

-5.4

-4.7

-5.4

-6.2

-4.3

p-cymene

-5.6

-5.6

-5.5

-5.5

-4.7

-5.4

-6.0

-4.3