Rate constant estimates from numerical modeling of TDI data in CYP2D6 baculosomes. Dashes indiciate an absence of the corresponding rate constant from the model.
| Rate Constant | EM | QI | ||
|---|---|---|---|---|
| Irreversiblea | Reversible | Irreversiblea | Reversible | |
| min−1 | ||||
| k3 | 22.61 ± 0.317 | 22.63 ± 0.310 | 22.61 ± 0.32 | 22.63 ± 0.31 |
| k6 | 1.650 ± 0.149 | 1.693 ± 0.134 | 1.648 ± 0.148 | 1.692 ± 0.134 |
| k7 | 0.0559 ± 0.0056 | 0.0586 ± 0.0029 | 0.0556 ± 0.0056 | 0.0584 ± 0.0029 |
| k8 | −0.0023 ± 0.0040 | 0.0240 ± 0.0017 | −0.0022 ± 0.0040 | 0.0240 ± 0.0017 |
| k9 | 0.0239 ± 0.0017 | — | 0.0239 ± 0.0017 | — |
↵a The entire set of model fits was invalidated by the negative value output.