Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-09-05 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.00002 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 86.911, 86.921, 103.297 |
Unit cell angles | 90.00, 94.38, 90.00 |
Refinement procedure
Resolution | 45.830 - 2.590 |
R-factor | 0.2413 |
Rwork | 0.239 |
R-free | 0.28750 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.821 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.830 | 2.680 |
High resolution limit [Å] | 2.590 | 2.590 |
Rmerge | 0.082 | 0.556 |
Number of reflections | 47823 | 4734 |
<I/σ(I)> | 8.25 | |
Completeness [%] | 99.5 | |
Redundancy | 3.3 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.4 | 293 | 16% PEG8000 0.04M potassium phosphate dibasic 20% glycerol |