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 | 2019-09-23 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 90.781, 90.781, 122.616 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 78.620 - 1.440 |
R-factor | 0.14351 |
Rwork | 0.142 |
R-free | 0.17007 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.013 |
RMSD bond angle | 1.667 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 78.620 | 1.690 |
High resolution limit [Å] | 1.440 | 1.440 |
Rmerge | 0.035 | 0.483 |
Rmeas | 0.041 | 0.567 |
Number of reflections | 104088 | 39885 |
<I/σ(I)> | 17.77 | 2.8 |
Completeness [%] | 98.3 | 99.7 |
Redundancy | 3.6 | 3.6 |
CC(1/2) | 0.999 | 0.839 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | 0.10 M NaAcetate pH 4.8, 2.0 M (NH4)2SO4, 30 % Glycerol |