Figure 2 | Scientific Reports

Figure 2

From: Synthesis, in vitro urease inhibitory potential and molecular docking study of benzofuran-based-thiazoldinone analogues

Figure 2

Urease enzyme (PDB code 4UBP) catalytic site binding mode analysis of the most potent scaffolds. (A) Urease enzyme (PDB ID 4UBP) surface representation, hydrophilic and hydrophobic regions are colored to blue and green, furthermore, two Nickle ions (799 and 798) are shown in sphere. In dark black color dotted lines, the hydrogen bonding is shown, and π-stacking interactions are shown by both sided arrows. (B) Scaffold-1 mode of interaction (C) Scaffold-5 and (D) Scaffold-3 and (E) Scaffold-8.

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