Inhibition of 3-deoxy-D-arabino-heptulosonate 7-phosphate synthase from Mycobacterium tuberculosis: In silico screening and in vitro validation

To identify the drug lead compounds to inhibit the function of mtDAH7Ps, enzyme inhibition activity were performed for compounds short-listed using E-pharmacophore modeling, induce fit docking, Prime MM/GBSA and validated by molecular dynamics.