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. 2020 Jun 22;12(12):11349–11363. doi: 10.18632/aging.103113

Table 5. Hydrogen bond interaction parameters for each compound and IDO residues.

Receptor Compound Donor atom Receptor atom Distances (Å)
IDO Epacadostat A:CYS129: SG Epacadostat: F7 3.09
A:CYS129:SG Epacadostat:Br8 2.62
A:ALA264:N9 Epacadostat:O12 3.11
A:ALA264:N9 Epacadostat:N9 2.83
ZINC000003791817 A:GLY261: HN ZINC000003791817: O7 2.52
A:SER167: OG ZINC000003791817: H57 2.04
A: PHE163:O ZINC000003791817: H57 3.01
ZINC000012495022 A:GLY236:HN ZINC000012495022:O7 2.01