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. 2022 Feb 18;17(9):e202100755. doi: 10.1002/cmdc.202100755

Figure 9.

Figure 9

Docking pose of 6 d (A), 10 c (B) and VK‐1 (C) in the catalytic domain of HDAC1 (PDB: 5ICN)[39]. Ligands are colored yellow, the catalytic Zn2+‐ion is shown as a gray sphere. The protein backbone is shown as light‐blue cartoon including the wheat‐colored protein surface surrounding the ligand. Side chain amino acids that show specific interactions with the ligand as well as the ligands are depicted as sticks. Polar interactions are represented by dashed lines in yellow.