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Table 4 Binding energies (kcal/mol) of the compounds along with their Root Mean Square Distance value obtained from Autodock Vina tool

From: Molecular-docking study of malaria drug target enzyme transketolase in Plasmodium falciparum 3D7 portends the novel approach to its treatment

Compound 1 2 3 4 5 6 7 8 9
6′-Methyl-Thiamin Diphosphate -6.6 -6.4 -6.0 -5.4 -5.4 -5.4 -5.1 -5.1 -5.0
dist from best mode rmsd l.b. 0.000 3.252 2.378 3.123 4.875 2.724 5.149 25.545 26.623
dist from best mode rmsd u.b. 0.000 4.402 5.402 6.050 5.978 4.884 7.100 28.035 28.663