Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-05-15 |
Detector | DECTRIS PILATUS 2M-F |
Wavelength(s) | 0.99999 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 126.960, 126.960, 124.600 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.890 - 2.171 |
Rwork | 0.214 |
R-free | 0.24460 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6yul |
RMSD bond length | 0.010 |
RMSD bond angle | 1.420 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0257) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.890 | 2.230 |
High resolution limit [Å] | 2.170 | 2.170 |
Number of reflections | 54337 | 4362 |
<I/σ(I)> | 16.3 | |
Completeness [%] | 100.0 | |
Redundancy | 26.5 | |
CC(1/2) | 0.999 | 0.761 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2 M ammonia sulphate 0.1 M bis-tris pH 5.5 23-26% PEG 3350 |