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. 2023;24(8):2601–2614. doi: 10.31557/APJCP.2023.24.8.2601

Table 10.

Summary of D-limonene, Doxorubicin, & Temozolomide docked with Mitogen-Activated Protein Kinase 6

No. Protein Compound Binding Energy (Kcal/Mol) Inhibition constant (Ki) (mM) No. of H-bonds Amino Acid involved in interaction
1 Mitogen-activated protein kinase 6 (6DTL) D-limonene -5.59 79.87 0 Lys191(A), Tyr229(A), Arg230(A), Leu234(A), Ile245(A)
2 Mitogen-activated protein kinase 6 Doxorubicin -5.58 81.68 8 Val270(A), Arg297(A). Tyr298(A), Leu235(A), Asn237(A), Asp268(A),
His269(A)
3 Mitogen-activated protein kinase 6 Temozolomide -4.84 282.85 8 Ser238(A), Thr242(A), Pro333(A), Arg334(A)