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. 2024 Mar 8;16(8):737–749. doi: 10.4155/fmc-2023-0343

Table 3.

The binding affinity of chloroquine analogs.

Docking results against Protein Data Bank ID 1PFK
Analog/drug Affinity (kcal/mol)
CS1 -6.4780
CS2 -5.1431
CS3 -5.6393
CS4 -5.9502
CS4 -6.2490
CS5 -5.8908
CS6 -6.2473
CS7 -6.9568
CS8 -6.4193
CS9 -6.0407
Doxorubicin -5.0226

PDB ID 1PFK is the crystal structure of the complex of Escherichia coli phosphofructokinase with its reaction products.

Results were obtained using Molecular Operating Environment (MOE) software.

PDB: Protein Data Bank.