Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 298 |
Detector technology | PIXEL |
Collection date | 2024-01-19 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.87313 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 46.802, 46.802, 144.376 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.270 - 1.530 |
Rwork | 0.177 |
R-free | 0.20770 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.013 |
RMSD bond angle | 2.027 |
Data reduction software | autoPROC |
Data scaling software | autoPROC |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.270 | 1.585 |
High resolution limit [Å] | 1.530 | 1.530 |
Rmeas | 0.025 | 0.164 |
Number of reflections | 25209 | 2454 |
<I/σ(I)> | 16.9 | 4.76 |
Completeness [%] | 100.0 | 100 |
Redundancy | 2 | 2 |
CC(1/2) | 1.000 | 0.963 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293 | 0.1 M Bis-Tris, pH 5.5, 2 M ammonium sulfate |