2HXR
Structure of the ligand binding domain of E. coli CynR, a transcriptional regulator controlling cyanate metabolism
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-12-22 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97885, 0.97874 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 87.913, 98.555, 62.236 |
Unit cell angles | 90.00, 104.35, 90.00 |
Refinement procedure
Resolution | 19.980 - 2.050 |
R-factor | 0.239 |
Rwork | 0.239 |
R-free | 0.25600 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.500 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXCD |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.120 |
High resolution limit [Å] | 2.050 | 2.050 |
Number of reflections | 57793 | |
<I/σ(I)> | 13.8 | 2.9 |
Completeness [%] | 89.9 | 65.9 |
Redundancy | 2.4 | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.2M Sodium formate, 22% PEG3350, VAPOR DIFFUSION, HANGING DROP, temperature 298K |