TABLE 4.
Energy score (kcal mol-1) calculation for SCZ and its metal complexes toward four protein receptors.
| Protein/complex | SCZ | Cu–SCZ | Co–SCZ | Ni–SCZ | Fe–SCZ | Zn–SCZ | |
|---|---|---|---|---|---|---|---|
| Colon cancer protein | 2X7F | –5.67657 | –6.67613 | –6.39108 | –5.68732 | –6.39108 | –6.36569 |
| 4F9M | –6.55138 | –7.24939 | –6.71789 | –6.88243 | –6.80609 | –7.2411 | |
| Breast cancer protein | 3ERT | –6.02021 | –6.5352 | –6.18126 | –6.0157 | –6.24734 | –6.01604 |
| 1H7K | –5.49007 | –7.73247 | –6.22617 | –6.80484 | –6.55553 | –7.10101 | |