Table 1.
Predicted and Experimental Alignment Tensors
Azzc | R | α (deg) | β (deg) | γ (deg) | |
---|---|---|---|---|---|
monomera | −33.4 × s | 0.329 | 89.7 | 40.5 | 194 |
dimera | −56.9 × s | 0.624 | 53.2 | 40.7 | 286 |
trimera | 62.3 × s | 0.0099 | 141 | 15.9 | 6.37 |
SVDb | (41.6 ± 0.7) × s | 0.483 ± 0.014 | 77.7 ± 1.0 | 45.9 ± 3.0 | 338 ± 6 |
Both predicted and experimental alignment tensors were calculated in PALES. The coordinates used for different oligomer are described in Materials and Methods.
Singular-value decomposition (SVD) was used to derive the experimental tensor. The error range was estimated using the Monte Carlo method.
The axial component of alignment tensor Azz was scaled from the predicted irreducible alignment magnitude by an arbitrary factor s.