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. Author manuscript; available in PMC: 2022 Jun 24.
Published in final edited form as: J Phys Chem B. 2021 Jun 9;125(24):6513–6521. doi: 10.1021/acs.jpcb.1c03144

Figure 3.

Figure 3.

Plot of atomic distances for the γ phosphate (Pγ), β oxygen (Oβ) bond of ATP along with the deprotonation of the attacking water (HWa) by GLU466 (Oglu) and subsequent attack of the newly formed hydroxide (OWa) to the γ phosphate from a representative trajectory.