2QXY
Crystal structure of a response regulator from Thermotoga maritima
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X12C |
Synchrotron site | NSLS |
Beamline | X12C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-08-11 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.97900 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 42.720, 71.874, 94.438 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.220 - 1.950 |
R-factor | 0.219 |
Rwork | 0.219 |
R-free | 0.24000 |
Structure solution method | SAD |
RMSD bond length | 0.005 |
RMSD bond angle | 1.200 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXD |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.010 |
High resolution limit [Å] | 1.950 | 1.950 |
Rmerge | 0.050 | 0.351 |
Number of reflections | 21986 | |
<I/σ(I)> | 21.5 | 2.5 |
Completeness [%] | 100.0 | 100 |
Redundancy | 14.3 | 14.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 298 | 0.2 M Ammonium sulfate, 0.1 M Sodium acetate pH 4.6, 25% PEG 4000, VAPOR DIFFUSION, SITTING DROP, temperature 298K |