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. 2022 May 4;12:7302. doi: 10.1038/s41598-022-10776-x

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(A) Reaction catalyzed by Heptosyltransferase I with deacylated derivatives used in experiments (ODLA) and molecular dynamic simulations (FDLA) highlighted based on acyl substituents. (B) Fully bound substrate ternary model of Heptosyltransferase I colored by secondary structure (red: α-helix, cyan: β-strand, white: random coil).