Figure 2 | Scientific Reports

Figure 2

From: Molecular Dynamics Simulation reveals the mechanism by which the Influenza Cap-dependent Endonuclease acquires resistance against Baloxavir marboxil

Figure 2

Interaction Fraction summary of CEN-BXA contacts. This graph is normalized by the total simulation time. Interaction-fraction values over 1.0 indicate that the residue has multiple contact routes to interact with the ligand. (A) Interaction fraction of BXA with the wild-type CEN protein (PDBID: 6FS6), (B) Interaction fraction of BXA with CEN having the I38T mutation (PDBID: 6FS7), (C) Interaction fraction of BXA with CEN having the I38F mutation, (D) Interaction fraction of BXA with CEN having the I38M mutation.

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