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 | 2021-02-10 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 1.00003231311 |
Spacegroup name | I 2 3 |
Unit cell lengths | 145.160, 145.160, 145.160 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 72.690 - 2.060 |
R-factor | 0.1692 |
Rwork | 0.168 |
R-free | 0.19650 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.571 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 72.690 | 2.092 |
High resolution limit [Å] | 2.057 | 2.057 |
Number of reflections | 802325 | 1561 |
<I/σ(I)> | 22.3 | |
Completeness [%] | 100.0 | |
Redundancy | 25.3 | |
CC(1/2) | 1.000 | 0.559 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | sodium tartrate, sodium acetate, ammonium chloride |