Figure 10
(A) Hydrophobic matching map of Pinocembrin (blue), LPS (pink) and TLR4/MD2 complex. (blue and orange areas on the protein surface indicate hydrophilic and hydrophobic regions, respectively). (B) The binding mode of Pinocembrin and MD2. (a: yellow stick represents Pinocembrin, cyan stick indicates the residues involved in interactions, hydrogen bond is shown in blue dash line; b: π–π interaction is shown in green sphere and dash line, the black dotted line indicates hydrogen bond, and the green curve indicates hydrophobic interactions)
Pinocembrin blocked the binding of LPS to MD2 protein by competitive occupancy with LPS

(A) Hydrophobic matching map of Pinocembrin (blue), LPS (pink) and TLR4/MD2 complex. (blue and orange areas on the protein surface indicate hydrophilic and hydrophobic regions, respectively). (B) The binding mode of Pinocembrin and MD2. (a: yellow stick represents Pinocembrin, cyan stick indicates the residues involved in interactions, hydrogen bond is shown in blue dash line; b: π–π interaction is shown in green sphere and dash line, the black dotted line indicates hydrogen bond, and the green curve indicates hydrophobic interactions)

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