5UB3
XAC2383 from Xanthomonas citri bound to chloride ion
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | LNLS BEAMLINE W01B-MX2 |
Synchrotron site | LNLS |
Beamline | W01B-MX2 |
Temperature [K] | 93 |
Detector technology | PIXEL |
Collection date | 2014-01-02 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 1.54 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 66.544, 66.860, 113.033 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.870 - 1.900 |
R-factor | 0.17945 |
Rwork | 0.177 |
R-free | 0.22607 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.017 |
RMSD bond angle | 1.895 |
Data reduction software | HKL-2000 |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 29.870 |
High resolution limit [Å] | 1.900 |
Rmerge | 0.068 |
Number of reflections | 39032 |
<I/σ(I)> | 11.74 |
Completeness [%] | 96.4 |
Redundancy | 3.6 |
CC(1/2) | 0.970 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | BATCH MODE | 298 | 20mM Tris pH 8.0, 300mM NaCl |