2VUC
PA-IIL lectin from Pseudomonas aeruginosa complexed with Fucose- derived glycomimetics
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 300 |
Detector technology | CCD |
Collection date | 2006-04-28 |
Detector | ADSC CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 52.555, 72.668, 54.725 |
Unit cell angles | 90.00, 94.42, 90.00 |
Refinement procedure
Resolution | 54.550 - 1.300 |
R-factor | 0.133 |
Rwork | 0.132 |
R-free | 0.15300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1uzv |
RMSD bond length | 0.012 |
RMSD bond angle | 1.559 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 27.280 | 1.370 |
High resolution limit [Å] | 1.300 | 1.300 |
Rmerge | 0.160 | 0.110 |
Number of reflections | 100063 | |
<I/σ(I)> | 18.6 | 9.5 |
Completeness [%] | 99.4 | 99.5 |
Redundancy | 3.7 | 3.6 |
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 COMPLEX WAS OBTAINED BY SOAKING METHOD FROM FUCOSE-CONTAINING CRYSTAL) |