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Table 1 Energies obtained after docking of withaferin A into Hsp90

From: Hsp90/Cdc37 Chaperone/co-chaperone complex, a novel junction anticancer target elucidated by the mode of action of herbal drug Withaferin A

Property

Quantity

Binding Energy

-9.10 Kcal/mol

Inhibition constant

214.73 nM

Intermolecular energy

-10.36 Kcal/mol

Total internal energy

-0.11 Kcal/mol