5KQO
1-deoxy-D-xylulose 5-phosphate reductoisomerase from Vibrio vulnificus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-BM |
| Synchrotron site | APS |
| Beamline | 22-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-03-07 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.000 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 65.533, 148.923, 244.055 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.350 |
| R-factor | 0.18605 |
| Rwork | 0.185 |
| R-free | 0.21014 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1q0l |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.639 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | HKL-3000 |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.390 |
| High resolution limit [Å] | 2.350 | 2.350 |
| Rmerge | 0.050 | 0.275 |
| Number of reflections | 49916 | |
| <I/σ(I)> | 33.2 | 4.7 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 4.5 | 4.6 |
| CC(1/2) | 0.948 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 0.1 M Sodium citrate/citric acid pH 5.0 1.2 M Ammonium phosphate dibasic 0.2 M Sodium chloride |
