3U1D
The structure of a protein with a GntR superfamily winged-helix-turn-helix domain from Halomicrobium mukohataei.
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 | 2011-07-03 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97912 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 57.214, 57.214, 218.354 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.800 |
R-factor | 0.17264 |
Rwork | 0.171 |
R-free | 0.19414 |
Structure solution method | SAD |
RMSD bond length | 0.014 |
RMSD bond angle | 1.573 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MLPHARE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.830 |
High resolution limit [Å] | 1.800 | 4.880 | 1.800 |
Rmerge | 0.082 | 0.062 | 0.869 |
Number of reflections | 34958 | ||
<I/σ(I)> | 7.7 | ||
Completeness [%] | 99.9 | 98.4 | 100 |
Redundancy | 14.1 | 12.2 | 14.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 277 | 0.2M MgCl2, 0.1M Tris:HCl pH 8.5, 25% PEG 3350, VAPOR DIFFUSION, SITTING DROP, temperature 277K |