4KNC
Structural and functional characterization of Pseudomonas aeruginosa AlgX
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X29A |
Synchrotron site | NSLS |
Beamline | X29A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-10-01 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.075 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 123.697, 82.435, 92.678 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.643 - 2.141 |
R-factor | 0.1781 |
Rwork | 0.176 |
R-free | 0.23120 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.038 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER (2.5.3) |
Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.230 |
High resolution limit [Å] | 2.141 | 4.630 | 2.141 |
Rmerge | 0.081 | 0.055 | 0.640 |
Number of reflections | 52346 | ||
<I/σ(I)> | 10.8 | ||
Completeness [%] | 99.9 | 98.8 | 100 |
Redundancy | 9.7 | 9.3 | 9.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.9 | 293 | 25% PEG3000, 100 mM sodium citrate, pH 4.9, VAPOR DIFFUSION, HANGING DROP, temperature 293K |