6E3N
The N-terminal domain of PA endonuclease from the influenza H1N1 virus in complex with 3-hydroxy-4-oxo-6-(o-tolyl)-1,4-dihydropyridine-2-carboxylic acid
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-09-18 |
| Detector | APEX II CCD |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 62 2 2 |
| Unit cell lengths | 74.481, 74.481, 119.189 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 37.240 - 3.190 |
| R-factor | 0.20973 |
| Rwork | 0.195 |
| R-free | 0.28475 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.249 |
| Data reduction software | APEX (APEX3) |
| Data scaling software | APEX (APEX3) |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.240 | 3.290 |
| High resolution limit [Å] | 3.190 | 3.190 |
| Rmerge | 0.183 | 0.423 |
| Number of reflections | 3603 | 286 |
| <I/σ(I)> | 13.83 | 3.27 |
| Completeness [%] | 99.7 | 99 |
| Redundancy | 18.95 | 12.97 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.8 | 306 | 30% PEG4000, 100 mM Tris, pH 8.35, 200-220 mM sodium acetate |
