2X26
Crystal structure of the periplasmic aliphatic sulphonate binding protein SsuA from Escherichia coli
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-09-16 |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 40.891, 96.026, 142.401 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 79.620 - 1.750 |
R-factor | 0.18784 |
Rwork | 0.186 |
R-free | 0.22538 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3e4r |
RMSD bond length | 0.017 |
RMSD bond angle | 1.619 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | BALBES |
Refinement software | REFMAC (5.5.0106) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 71.200 | 1.840 |
High resolution limit [Å] | 1.750 | 1.750 |
Rmerge | 0.060 | 0.410 |
Number of reflections | 57014 | |
<I/σ(I)> | 9.7 | 1.8 |
Completeness [%] | 99.1 | 99.2 |
Redundancy | 3.4 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 293 | 22% PEG3350, 0.2M SODIUM FORMATE AT 293K IN 2 DAYS, pH 7.5 |