3LUQ
The Crystal Structure of a PAS Domain from a Sensory Box Histidine Kinase Regulator from Geobacter sulfurreducens to 2.5A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-01-01 |
Detector | ADSC QUANTUM 315 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 62.545, 71.971, 67.374 |
Unit cell angles | 90.00, 113.05, 90.00 |
Refinement procedure
Resolution | 35.990 - 2.490 |
R-factor | 0.231 |
Rwork | 0.228 |
R-free | 0.27900 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.381 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHELX |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.590 |
High resolution limit [Å] | 2.490 | 2.500 |
Rmerge | 0.088 | 0.680 |
Number of reflections | 19104 | |
<I/σ(I)> | 11.8 | |
Completeness [%] | 98.3 | 97.9 |
Redundancy | 4.3 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 9.5 | 289 | 30% PEG 3000, 0.1M CHES pH 9.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K |