Table 2.

Interacting sites of RdRp (nsp12) involved in the interaction with viral RNA in the absence and presence of drugs as found by the computational approaches used in this study.

nsp12/RNA		nsp12/RNA in the presence of drugs
		IDX_184		Remdesivir		Galidesivir		Ribavirin
Position	Residue	Position	Residue	Position	Residue	Position	Residue	Position	Residue
39	Asn	499	Asp	499	Asp	499	Asp	492	Gln
41	Lys	521	Tyr	521	Tyr	521	Tyr	499	Asp
78	Ser	814	Ser	814	Ser	814	Ser	521	Tyr
725	His	861	Ser	861	Ser	861	Ser	814	Ser
729	Glu	903	Tyr	903	Tyr	903	Tyr	861	Ser
733	Arg							903	Tyr
734	Asn
nsp12/RNA		nsp12/RNA in the presence of drugs
		Setrobuvir		Sofosbuvir		Tenofovir		YAK
Position	Residue	Position	Residue	Position	Residue	Position	Residue	Position	Residue
39	Asn	38	Tyr	499	Asp	499	Asp	499	Asp
41	Lys	40	Asp	521	Tyr	521	Tyr	521	Tyr
78	Ser	78	Ser	814	Ser	814	Ser	814	Ser
725	His	79	Asn	903	Tyr	861	Ser	861	Ser
729	Glu	220	Gly			903	Tyr	903	Tyr
733	Arg	722	Asn
734	Asn	734	Asn