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. 2021 Jul 15;6(29):18823–18835. doi: 10.1021/acsomega.1c02046

Table 1. Binding Energies and Binding Constants for the Interaction of Coumarin with Different Proteins Obtained Using AutoDock Vina.

S. no. PDB ID protein name binding energy (kcal mol–1) binding constant (M–1)
1. 1RO5 LasI –5.7 1.5 × 104
2. 1KZF EsaI –6.6 6.9 × 104
3. 2UV0 LasR –8.1 8.7 × 105
4. 3IT7 LasA –7.5 3.1 × 105
5. 3QP5 CviR –7.7 4.4 × 105
6. 3QP1 CviR′ –7.7 4.4 × 105
7. 4JVI PqsR –6.5 5.8 × 104
8. 3JVV PilT –6.3 4.1 × 104
9. 3HX6 PilY1 –6.3 4.1 × 104
10.   RhlR –6.4 4.9 × 104