5TPV
X-ray structure of WlaRA (TDP-fucose-3,4-ketoisomerase) from Campylobacter jejuni
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | LIQUID ANODE |
| Source details | Excillum MetalJet D2+ 160 kV |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-08-11 |
| Wavelength(s) | 1.3418 |
| Spacegroup name | I 4 2 2 |
| Unit cell lengths | 177.953, 177.953, 88.600 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 125.830 - 2.140 |
| R-factor | 0.20981 |
| Rwork | 0.207 |
| R-free | 0.26317 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5tpu |
| RMSD bond length | 0.013 |
| RMSD bond angle | 2.135 |
| Data reduction software | SAINT |
| Data scaling software | SADABS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0124) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.240 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Rmerge | 0.071 | 0.362 |
| Number of reflections | 39045 | |
| <I/σ(I)> | 11.4 | 2.8 |
| Completeness [%] | 99.3 | 96.2 |
| Redundancy | 7.1 | 5.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 8-10% PEG-8000, 1.25 M tetraethylammonium chloride, 2% dimethylsulfoxide, 5mM TDP |
