Molecular Dynamics Simulations of A27S and K120A Mutated PTP1B Reveals Selective Binding of the Bidentate Inhibitor

<div>(a) Superimposed structures of PTP1B (PDB ID: 1Q1M) and TCPTP (PDB ID: 1L8K) which are shown in blue and red, respectively. The inhibitor is shown by ball-and-stick with a transparent surface. (b) Structure of the inhibitor labeled with oxygen and nitrogen atoms.</div>

BioMed Research International

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Figure 1

Figure 1: Molecular Dynamics Simulations of A27S and K120A Mutated PTP1B Reveals Selective Binding of the Bidentate Inhibitor 