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For Cagri:AMY 3 R:G s , histidine side chains were predicted in the tautomeric state except H223, H302 (CTR), H18 (Cagri), H97 (RAMP3), H142, and H183 (G), which were modelled as tautomer

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Cell Metabolism, 34(9), 1234-1247

Furthermore, MD revealed decreased flexibility of p53 TAD2 in complex with FOXO4-DRI compared to the FOXO4 FH -bound state with RMSDs of 1 heteronuclear NOE data was recorded using the HSQCNOEF3GPSI bruker pulse sequence (32 scans, 256 points in F1, 1024 points in F2, 1278.772 Hz spectral width in F1, 9615.385 Hz spectral width in F2) using a three seconds saturation period

The lipidomic analysis of 4-OXO-DHA in plasma of rats fed DHA was determined but the MS conditions were modified (DP = -85 and temp = 300)