4XX2
Ohr from Xylella fastidiosa in oxidized state
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | LNLS BEAMLINE D03B-MX1 |
Synchrotron site | LNLS |
Beamline | D03B-MX1 |
Temperature [K] | 275 |
Detector technology | CCD |
Collection date | 2010-08-10 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.43 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 87.813, 83.693, 60.766 |
Unit cell angles | 90.00, 93.67, 90.00 |
Refinement procedure
Resolution | 60.630 - 2.150 |
R-factor | 0.17912 |
Rwork | 0.176 |
R-free | 0.22642 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1zb8 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.538 |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 60.630 | 2.270 |
High resolution limit [Å] | 2.150 | 2.150 |
Number of reflections | 23868 | |
<I/σ(I)> | 13.9 | 3 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 3.1 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | sodium citrate, sodium cacodylate |