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Here, molecular docking and molecular dynamics (MD) simulations were performed to assess the contribution of Ca2+ ion toward the folding and stabilization associated with the RTX lipase (AMS8 lipase) structure. AMS8 lipase contains six Ca2+ ions (Ca1-Ca6). Three Ca2+ ions (Ca3, Ca4, and Ca5) were bound into the RTX parallel β-roll motif repeat construction (RTX domain). The material ion (Ca2+) docking analysis offers a high binding power, specificall
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