Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-07-02 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9998 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 99.433, 136.936, 38.653 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 80.460 - 1.240 |
R-factor | 0.13513 |
Rwork | 0.133 |
R-free | 0.17090 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.012 |
RMSD bond angle | 1.503 |
Data reduction software | autoPROC |
Data scaling software | autoPROC ((Version 1.1.7)) |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 80.460 | 1.340 |
High resolution limit [Å] | 1.240 | 1.244 |
Rmerge | 0.039 | 1.164 |
Rmeas | 0.037 | |
Number of reflections | 119188 | 5959 |
<I/σ(I)> | 20.6 | 1.4 |
Completeness [%] | 80.0 | 20.3 |
Redundancy | 8.1 | 7.3 |
CC(1/2) | 0.999 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.5 | 285 | 19% (w/v) PEG3350, 0.17M Magnesium formate |