5W26
INFLUENZA VIRUS NEURAMINIDASE N9 IN COMPLEX WITH 4-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 | 2009-08-19 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.9532 |
| Spacegroup name | I 4 3 2 |
| Unit cell lengths | 180.940, 180.940, 180.940 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 42.000 - 1.900 |
| R-factor | 0.139 |
| Rwork | 0.136 |
| R-free | 0.17700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4weg |
| RMSD bond length | 0.020 |
| RMSD bond angle | 2.017 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0151) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.360 | 1.950 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.170 | 0.750 |
| Number of reflections | 37832 | 2735 |
| <I/σ(I)> | 39 | 1.5 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 72 | 25 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.7 | 298 | 1.7M POTASSIUM PHOSPHATE |
