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. 2021 Jul 13:10.2217/fvl-2020-0361. doi: 10.2217/fvl-2020-0361

Table 2. Common name of drug, structure and binding affinity from Autodock Vina and interacting residues.

Drug Name Structure Binding energy Residues
Aenosine-5-diphosphoribose graphic file with name fvl-2020-0361T1a.gif -9.1 Ala21, Asp22, Ile23, Ala38, Asn40, Lys44, His45, Gly46, Gly47, Gly48, Val49, Leu126, Ser128, Ala129, Gly130, Ile131, Phe132, Ala154, Phe156, Leu160
Saquinavir graphic file with name fvl-2020-0361T1b.gif -10.3 Asp22, Ile23, Ala38, Asn40, Gly46, Gly48, Gly47, Val49, Ala52, Pro125, Leu126, Ser128, Ala129, Gly130, Ile131, Phe132, Ala154, Asp157, Phe156
Trifluperidol graphic file with name fvl-2020-0361T1c.gif -10.2 Asp22, Ile23, Ala38, Asn40, Gly46, Gly47, Gly48, Val49, Gly51, Ala52, Pro125, Leu126, Ser128, Ala129, Gly130, Ile131, Phe132, Ala154, Val155, Phe156, Asp157
Deferasirox graphic file with name fvl-2020-0361T1d.gif -10.0 Ala38, Gly48, Val49, Pro125, Leu126, Ser128, Ala129, Gly130, Ile131, Phe132, Gly133, Val155, Phe156, Asp157, Leu160
Droperidol graphic file with name fvl-2020-0361T1e.gif -10.0 Ile23, Ala38, Gly48, Val49, Pro125, Leu126, Ser128, Ala129, Gly130, Ile131, Phe132, Ala154, Val155, Phe156, Asp157, Leu160