| βI | βIIa | βIIb | βIII | βIVa | βIVb | βV | βVI |
---|
PELA | -22.6 | -20.3 | -10.6 | -7.9 | -18.2 | -2.1 | -22.0 | 0 |
LAU | 0 | 0 | -30.0 | 0 | 0 | -21.9 | -34.9 | 0 |
- Binding energy differences in (kcal/mol) for peloruside A (PELA) and laulimalide (LAU) as a function of the β-tubulin isotypes. These values are based on molecular dynamics calculations [19].