Table 1.
Comparison of the electrostatic free energy of interaction of the PLCδ1 PH domain in the absence and presence of bound Ins(1,4,5)P3 with a 2 : 1 PC/PS membrane in 0.1 M KCl
Ra (Å) | δGel (kcal/mole), δ1-PH, no Ins(1,4,5)P3 | δGel (kcal/mole), δ1-PH with bound Ins(1,4,5)P3 |
0 | 0.36 | 11.3 |
0.5 | −1.3 | 8.7 |
1.0 | −2.3 | 6.3 |
1.5 | −3.6 | 4.0 |
2.0 | −3.9 | 2.7 |
a R is the distance between the van der Waals surfaces of the PH domain and membrane. The electrostatic free energies were calculated by using the finite difference Poisson-Boltzmann (FDPB) method as described in Materials and Methods (Gallagher and Sharp 1998).