2JDK
Lectin PA-IIL of P.aeruginosa complexed with disaccharide derivative
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-12-12 |
Detector | ADSC CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 52.611, 73.078, 54.501 |
Unit cell angles | 90.00, 94.35, 90.00 |
Refinement procedure
Resolution | 54.310 - 1.100 |
R-factor | 0.113 |
Rwork | 0.112 |
R-free | 0.13400 |
Structure solution method | OTHER |
Starting model (for MR) | NONE |
RMSD bond length | 0.017 |
RMSD bond angle | 1.686 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 22.300 |
High resolution limit [Å] | 1.100 |
Rmerge | 0.050 |
Number of reflections | 165425 |
<I/σ(I)> | 18.7 |
Completeness [%] | 99.4 |
Redundancy | 5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8.5 | TRIS HCL 0.1M, PH8.5, 1.75 M AMMNONIUM SULFATE(THE PA-IIL/GLYCOMIMETIC COMPLEXE WAS OBTAINED BY SOAKING METHOD FROM FUCOSE-CONTAINING CRISTAL) |