Table 2.

Interactions between main polymerase, its ligand and HCQ/CQ.

Molecule	Docking score	Glide score	Glide emodel
Ligand of 6LU7	−8.110	−8.110	−99.643
HCQ	−4.228	−6.469	−52.728
CQ	−3.332	−5.008	−44.476

Ligand of 6LU7: (phenylmethyl) (4 ∼ {S})-4-[[(2 ∼ {S})-4-methyl-2-[[(2 ∼ {S})-3-methyl-2-[[(2 ∼ {S})-2-[(5-methyl-1,2-oxazol-3-yl)carbonylamino]propanoyl]amino]butanoyl]amino]pentanoyl]amino]-5-[(3 ∼ {S})-2-oxidanylidenepyrrolidin-3-yl]pent-2-enoate.