Table 1. Refinement statistics for the three P-glycoprotein crystallographic models [15–17].
Crystallographic refinement statistic | 3G5U | 4M1M | 4KSB |
---|---|---|---|
Resolution range high (Å) | 3.8 | 3.8 | 3.8 |
Resolution range low (Å) | 19.98 | 24.89 | 92.56 |
Number of reflections | 41131 | 41385 | 21753 |
R value (working set) | 0.306 | 0.267 | 0.357 |
Free R value | 0.346 | 0.267 | 0.357 |
Free R value test set | 4203 | 4203 | 1062 |
Estimated coordinate error (maximum likelihood) | - | 0.46 | 0.82 |
Phase error (degrees, maximum-likelihood) | - | 27.47 | 38.35 |
Luzzati plot | 0.86 | - | - |
SigmaA | 0.82 | - | - |
Ramachandran outliers (asymmetric unit) | 594 | 92 | 79 |
Atomic coordinates in asymmetric unit | 18352 | 18378 | 9171 |