2VUD
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 | 2006-04-26 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 53.079, 73.179, 55.367 |
| Unit cell angles | 90.00, 93.86, 90.00 |
Refinement procedure
| Resolution | 55.220 - 1.700 |
| R-factor | 0.204 |
| Rwork | 0.203 |
| R-free | 0.21800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1uzv |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.245 |
| 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] | 44.110 | 1.790 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.160 | 0.490 |
| Number of reflections | 46062 | |
| <I/σ(I)> | 7.3 | 2.2 |
| Completeness [%] | 99.1 | 98.5 |
| Redundancy | 3.7 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.5 | TRIS HCL 0.1M PH8.5, 1.75M AMMNONIUM SULFATE(THE PA-IIL/GLYCOMIMETIC COMPLEX WAS OBTAINED BY SOAKING METHOD FROM FUCOSE-CONTAINING CRYSTAL) |
