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 |