5W2U
INFLUENZA VIRUS NEURAMINIDASE N9 IN COMPLEX WITH 7-DEOXYGENATED 2,3-DIFLUORO-N-ACETYLNEURAMINIC ACID
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-04-20 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.95369 |
| Spacegroup name | I 4 3 2 |
| Unit cell lengths | 181.025, 181.025, 181.025 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.380 - 2.000 |
| R-factor | 0.144 |
| Rwork | 0.142 |
| R-free | 0.18700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4weg |
| RMSD bond length | 0.021 |
| RMSD bond angle | 2.078 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.380 | 2.050 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.308 | 0.760 |
| Number of reflections | 32364 | |
| <I/σ(I)> | 10 | 1.3 |
| Completeness [%] | 99.6 | 99.8 |
| Redundancy | 78.4 | 32 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.7 | 289 | 1.7M POTASSIUM PHOSPHATE |
