1ULE
CGL2 in complex with linear B2 trisaccharide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-03-17 |
Detector | MARRESEARCH |
Wavelength(s) | 0.9998 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 66.315, 66.315, 218.469 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.030 - 2.150 |
Rwork | 0.198 |
R-free | 0.23100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | CGL2-Lactose |
RMSD bond length | 0.005 |
RMSD bond angle | 1.400 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.030 | 2.230 |
High resolution limit [Å] | 2.150 | 2.150 |
Rmerge | 0.062 | |
Number of reflections | 27145 | |
<I/σ(I)> | 32.2 | |
Completeness [%] | 99.6 | 99.9 |
Redundancy | 7.5 | 5.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.3 | 291 | PEG 3350, PEG 400, sodium phosphate, sodium chloride, pH 7.3, VAPOR DIFFUSION, HANGING DROP, temperature 291K |