Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2019-11-24 |
Detector | DECTRIS EIGER2 X 9M |
Wavelength(s) | 0.99186 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 77.720, 81.797, 198.398 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 99.200 | 1.995 |
High resolution limit [Å] | 1.944 | 1.944 |
Number of reflections | 92354 | 5386 |
<I/σ(I)> | 18.9 | |
Completeness [%] | 98.5 | |
Redundancy | 12.9 | |
CC(1/2) | 0.999 | 0.897 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 294 | 1.6M ammonium sulphate and 1M lithium sulphate. |