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The impairment was positively associated with the extent of Hb glycosylation, and inversely associated with levels of vasodilator SNOs ( i ) implicated in transducing regulated ATP export ( Therapeutic Approaches to Modify Red Blood Cell ATP Content And/Or Export Augmenting ATP and 2,3-DPG in Red Blood Cells Used for Exchange Transfusion in SCD Patients Figure 2)

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Since the focus of this study is to investigate how UDP-Gal ligand and metal ion cofactor binding influence the structural stabilization of these domains rather than to observe conformational transitions, conventional MD simulations are sufficient to capture the relevant dynamics

J Allergy Clin Immunol 2019