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. Author manuscript; available in PMC: 2022 Jul 5.
Published in final edited form as: Eur J Med Chem. 2021 Apr 10;219:113446. doi: 10.1016/j.ejmech.2021.113446

Table 3.

Distance between ADP and the residues at the binding site of 5OAF (with ADP) and 6IGM (without ADP)

graphic file with name nihms-1692797-t0015.jpg
Residues Groups Labels (ADP) Distance (Å)
5OAF 6IGM
His20-A NH 16 2.5 5.0
Val40-A NH 1 2.8 3.1
NH 10 3.0 3.3
C=O 10 3.0 3.2
Gly73-A NH 26 3.0 2.7
Thr77-A NH 27 2.9 3.1
Arg378-A NH2 16 2.6 4.2
NH2 17 2.5 3.9
Arg404-A NH 19 2.5 2.8
Glu317-B C=O 25 2.9 2.5
Arg353-B NH 23 2.8 2.6
NH2 23 2.9 4.9