4YR7
Structure of LuxP In Complex With 1-deoxy-alpha-L-xylulofuranose-1,2-borate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-10-23 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97630 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 74.450, 85.230, 133.600 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 71.854 - 2.533 |
| R-factor | 0.1534 |
| Rwork | 0.151 |
| R-free | 0.20250 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1jx6 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.260 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 85.230 | 2.600 |
| High resolution limit [Å] | 2.530 | 2.530 |
| Rmerge | 0.068 | 0.846 |
| Number of reflections | 29003 | |
| <I/σ(I)> | 16.5 | 2.7 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 8.5 | 8.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 12% polyethylene glycol, 100 mM sodium cacodylate |
