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Interaction of NAAA with atractylodin. (A) Docking detail of the substrate-binding site of human NAAA (PDB ID: 6DXX) bound to the inhibitor atractylodin (light pink carbons). (B) The 2D Schematic diagram of the interaction. (C) The RMSD fluctuation of NAAA Cα atoms, and the RMSD fluctuation of Atractylodin along the 100 ns MD simulations.
