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Table 2 Stability assessments concerning hydrophobic interactions

From: Docking and ADMET studies for investigating the anticancer potency of Moscatilin on APC10/DOC1 and PKM2 against five clinical drugs

Ligand Target protein (PDB ID) Residue Amino acid Distance (Å) Ligand atom Protein atom
Moscatilin APC10/DOC1 (IJHJ) 98A Valine 2.69 1462 764
Resveratrol 108A Isoleucine 2.90 1458 845
Mitomycin-C 126A Aspartic acid 3.24 1466 991
Paclitaxel 28A Glutamine 2.85 1473 196
Colchicine 126A Aspartic acid 2.73 1460 991
Shikonin 73A Threonine 3.34 1457 564
Moscatilin PKM2 (IZJH) 42A Arginine 3.52 4010 147
Resveratrol 117A Glutamine 3.63 4007 719
Mitomycin-C No hydrophobic interactions
Paclitaxel 455A Asparagine 3.26 4050 3289
Colchicine 501A Phenylalanine 2.66 4019 3657
Shikonin 41A Alanine 2.87 4009 142