4CPZ
Structure of the Neuraminidase from the B/Lyon/CHU/15.216/2011 virus in complex with Zanamivir
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Detector | DECTRIS PILATUS 2M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 89.344, 163.255, 123.451 |
| Unit cell angles | 90.00, 108.31, 90.00 |
Refinement procedure
| Resolution | 48.503 - 2.200 |
| R-factor | 0.1556 |
| Rwork | 0.153 |
| R-free | 0.19970 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4cpo |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.126 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.500 | 2.240 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.070 | 0.570 |
| Number of reflections | 164411 | |
| <I/σ(I)> | 11.2 | 1.9 |
| Completeness [%] | 97.1 | 93.6 |
| Redundancy | 3.5 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 25% PEG 1500, 0.1M SUCCINIC ACID PH 9.0 |
