3H6J
Crystal structure of a putative neuraminidase from Pseudomonas aeruginosa
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4A |
| Synchrotron site | NSLS |
| Beamline | X4A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-04-23 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.9798 |
| Spacegroup name | P 21 3 |
| Unit cell lengths | 126.340, 126.340, 126.340 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 26.940 - 1.600 |
| R-factor | 0.172 |
| Rwork | 0.172 |
| R-free | 0.19100 |
| Structure solution method | SAD |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.400 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SnB |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.660 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.088 | 0.365 |
| Number of reflections | 88080 | |
| <I/σ(I)> | 11.8493 | 3.299 |
| Completeness [%] | 99.4 | 98.9 |
| Redundancy | 4.3 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 294 | 100 mM Hepes, 5% Tacsimate, 7% (w/v) PEGMME 5000, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 294K |
