Table 7. The hydrophobic interactions between the MMP-9 (PDB: 2OW0) and mulberrofuran H during the 20 ns simulations

Time Hydrophobic interactions
Complex MMP-9 (PDB: 2OW0) and Mulberrofuran H 0 ns Benzopyran – His401
Benzopyran – Leu418
Benzopyran – Leu397
Benzopyran – Tyr423
Tricyclo – Leu188
5 ns Benzopyran – Leu397
Benzopyran – His401
Benzopyran – Arg424
Benzopyran – Pro430
Tricyclo – Leu188
Tricyclo – Ala189
Tricyclo – Val398
10 ns Benzopyran – His401
Benzopyran – Tyr423
Tricyclo – Leu187
15 ns Benzopyran – His401
Benzopyran – Met422
Benzopyran – Tyr423
Tricyclo – Leu187
20 ns Benzopyran – Leu418
Benzopyran – His401
Benzopyran – Arg424
Benzopyran – Tyr423
Tricyclo – Leu187