8DHN
The N-terminal domain of PA endonuclease from the influenza H1N1 viral polymerase in complex with 6-Bromo-3-hydroxy-2-(5-methyl-1,2,4-oxadiazol-3-yl)pyridin-4(1H)-one
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2021-06-15 |
| Detector | APEX II CCD |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 62 2 2 |
| Unit cell lengths | 75.034, 75.034, 121.240 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 64.980 - 2.400 |
| R-factor | 0.2062 |
| Rwork | 0.201 |
| R-free | 0.25630 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6e6v |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.620 |
| Data reduction software | APEX 2 |
| Data scaling software | APEX 2 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 65.010 | 2.480 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.100 | 1.439 |
| Rmeas | 0.102 | |
| Rpim | 0.330 | |
| Number of reflections | 15004 | 806 |
| <I/σ(I)> | 20 | 2 |
| Completeness [%] | 99.9 | |
| Redundancy | 29 | |
| CC(1/2) | 1.000 | 0.840 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 32% PEG4000, 100 mM Tris, pH 8.35, 200-220 mM sodium acetate |
