TABLE 2.
Compound | Type of bond | Donor | Acceptor | Bond distance (Å) |
---|---|---|---|---|
Chloroquine | Hydrogen bond | ASN 501 (H) | CQ (N) | 2.61 |
Chloroquine | Π‐donor Hydrogen bond | GLY 496 (H) | CQ (π‐orbitals) | 2.86 |
Hydroxychloroquine | Hydrogen bond | TYR 449 (H) | HCQ (N) | 1.93 |
Hydroxychloroquine | Hydrogen bond | GLY 502 (H) | HCQ (O) | 1.81 |
Hydroxychloroquine | Hydrogen bond | HCQ 29 (H) | GLY 496 (O) | 2.30 |
Hydroxychloroquine | Hydrogen bond | HCQ 29 (H) | GLN 498 (O) | 3.09 |
Hydroxychloroquine | Π‐donor Hydrogen bond | TYR 449 (H) | HCQ (O) | 2.77 |