Table 2. Reflection statistics for C94A MAC-1 crystals in monoclinic and pseudo-orthorhombic settings calculated by phenix.xtriage .
| Space group | Theoretical values | |||
|---|---|---|---|---|
| P21 | P21212 | Untwinned | Perfect twin | |
| Acentric reflections | ||||
| 〈I2〉/〈I〉2 | 2.397 | 1.926 | 2.000 | 1.500 |
| 〈F〉2/〈F2〉 | 0.757 | 0.805 | 0.785 | 0.885 |
| 〈|E2 − 1|〉 | 0.800 | 0.701 | 0.736 | 0.541 |
| Centric reflections | ||||
| 〈I2〉/〈I〉2 | 3.645 | 2.781 | 3.000 | 2.000 |
| 〈F〉2/〈F2〉 | 0.618 | 0.688 | 0.637 | 0.785 |
| 〈|E2 − 1|〉 | 1.024 | 0.936 | 0.968 | 0.736 |
| Mean |L| | 0.476 | 0.468 | 0.500 | 0.375 |
| Mean L2 | 0.306 | 0.298 | 0.333 | 0.200 |