4ZU2
Pseudomonas aeruginosa AtuE
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE X13 |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | X13 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-11-06 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.8123 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 108.440, 133.970, 83.350 |
Unit cell angles | 90.00, 139.46, 90.00 |
Refinement procedure
Resolution | 19.693 - 2.150 |
R-factor | 0.2006 |
Rwork | 0.198 |
R-free | 0.25700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3H81 and 3I47 |
RMSD bond length | 0.015 |
RMSD bond angle | 1.523 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.250 |
High resolution limit [Å] | 2.130 | 2.130 |
Rmerge | 0.114 | 0.800 |
Number of reflections | 42012 | |
<I/σ(I)> | 8.4 | 1.2 |
Completeness [%] | 95.8 | 90.6 |
Redundancy | 2 | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289 | 0.2 M sodium iodide, 20 % (v/v) PEG 4000 |