2UY1
CRYSTAL STRUCTURE OF CSTF-77
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 44.440, 148.280, 91.440 |
Unit cell angles | 90.00, 92.15, 90.00 |
Refinement procedure
Resolution | 91.290 - 2.000 |
R-factor | 0.227 |
Rwork | 0.225 |
R-free | 0.28000 |
Structure solution method | OTHER |
RMSD bond length | 0.021 |
RMSD bond angle | 1.898 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 91.000 |
High resolution limit [Å] | 2.000 |
Rmerge | 0.080 |
Number of reflections | 77953 |
<I/σ(I)> | 15.1 |
Completeness [%] | 97.9 |
Redundancy | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |