Fig. 15 | Scientific Reports

Fig. 15

From: Integrating computational approaches to uncover β-lactamase-associated resistance in diarrheagenic Escherichia coli from pediatric patients

Fig. 15

Docking results of amoxicillin and ceftriaxone with β-lactamase genes. This figure illustrates the binding energy (K.cal/mol) and predicted IC50 values (nM/µM) for various drug targets when interacted with two compounds: amoxicillin and ceftriaxone. The bar plot represents the binding energy, with lighter blue bars for amoxicillin and darker blue bars for ceftriaxone. The line plot overlaying the bars represents the predicted IC50 values on a logarithmic scale, with a blue line for amoxicillin and a dark blue line for ceftriaxone. The x-axis lists the drug targets (TEM-1, SHV-1, CTX-M, OXA-1, NDM-1, and AmpC), while the y-axes display the binding energy on the left and the predicted IC50 values on the right. This dual representation allows for a comprehensive comparison of the binding affinity and inhibitory concentration of the two drugs across different targets.

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