Table 1. Data-collection and structure-refinement statistics.
MST1RASSF5 | MST1RASFF5 (SeMet) | MST2 | |
---|---|---|---|
Data collection | |||
Resolution () | 502.2 (2.282.20) | 501.9 (2.001.90) | 501.7 (1.761.70) |
Space group | C2221 | I4 | P41212 |
Wavelength () | 0.98000 | 0.97919 | 0.98000 |
Unit-cell parameters | |||
a () | 27.94 | 59.69 | 30.844 |
b () | 85.84 | 59.69 | 30.844 |
c () | 92.79 | 69.52 | 196.413 |
= = () | 90 | 90 | 90 |
Molecules per asymmetric unit | 1 | 1 | 1 |
Multiplicity | 4.0 (2.6) | 4.3 (4.3) | 10.1 (4.6) |
R merge (%) | 7.9 (20.6) | 7.3 (26.3) | 5.3 (20.6) |
Mean I/(I) | 14.3 (6.0) | 10.5 (3.9) | 19.2 (6.0) |
Completeness (%) | 96.9 (85.8) | 99.3 (98.9) | 93.7 (68.2) |
Refinement | |||
R work/R free | 0.2167/0.2778 | 0.2346/0.2722 | |
R.m.s.d., bond lengths () | 0.008 | 0.007 | |
R.m.s.d., bond angles () | 1.122 | 1.09 | |
Ramachandran plot | |||
Favoured regions (%) | 98.80 | 98.90 | |
Allowed regions (%) | 1.20 | 1.1 | |
Disallowed regions (%) | 0 | 0 | |
Average B factor (2) | |||
Chain A | 19.61 | 21.45 | |
Chain B | 17.54 | 20.94 | |
Water | 19.28 | 23.89 |