8PVT
Manganese-dependent transcriptional repressor DR2539 complexed with cadmium (SAD 7 keV)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-07-03 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.771200 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 60.846, 60.846, 187.469 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.590 - 2.500 |
R-factor | 0.2075 |
Rwork | 0.205 |
R-free | 0.25500 |
Structure solution method | SAD |
RMSD bond length | 0.004 |
RMSD bond angle | 0.706 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | SHELX |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.600 | 2.640 |
High resolution limit [Å] | 2.500 | 2.500 |
Number of reflections | 12916 | 1752 |
<I/σ(I)> | 14.3 | |
Completeness [%] | 99.4 | |
Redundancy | 23.2 | |
CC(1/2) | 0.998 | 0.869 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | 0.1 M Hepes pH 7.0; 1.2 M sodium acetate; 0.05 M Cadmium sulphate |