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The mass of purified apo-MTs (MT3-WT, GS-MT3, and G-MT3) and eSrtA was confirmed by electrospray ionization mass spectrometry (ESIMS) (Additional file 1: Fig

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SAMe has been compared to ATP in its importance for the organization

This technology can accurately predict the interaction forces (such as hydrogen bonds and hydrophobic interactions) between small molecule compounds and the active pockets of target proteins, accurately obtain binding conformations and binding energy data, and provide direct guidance for subsequent structural optimization