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. 2022 Sep 20;13:990779. doi: 10.3389/fneur.2022.990779

Table 1.

Results of molecular docking vina, discovery studio 2019.

Receptor Ligand ZDOCK score Hydrogen bond interaction Electrostatic interaction
PROK2 (1IMT) CSF3 (2D9Q) −85.085 B:ARG167:NH1—A:ASP109:OD1,
B:ARG167:NH2—A:ASP112:OD1,
B:ARG288:NH2—A:GLU19:OE1,
A:HOH177:O—A:PRO65:O…
A:LYS16:NZ—B:ASP197:OD1,
A:LYS16:NZ—B:ASP200:OD1,
B:ARG167:NH1—A:ASP112:OD2,
B:ARG288:NH1—A:GLU19:OE2,
A:LEU15—B:LEU291