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. Author manuscript; available in PMC: 2019 Dec 27.
Published in final edited form as: J Am Chem Soc. 2019 Sep 13;141(38):15092–15101. doi: 10.1021/jacs.9b06064

Figure 6. Two pathways of the DFG flip.

Figure 6.

Free energy surface of c-Src as a function of ϕ(Asp404) and ψ(Ala403) at different simulation pH conditions. A diagonal line separates the DFG-in and DFG-out conformations. Two pathways for the DFG flip are indicated.