5HWS
Crystal structure of ketopantoate reductase from Thermococcus kodakarensis complexed with NADP+
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL41XU |
| Synchrotron site | SPring-8 |
| Beamline | BL41XU |
| Temperature [K] | 95 |
| Detector technology | PIXEL |
| Collection date | 2015-01-28 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 |
| Unit cell lengths | 37.616, 44.944, 183.286 |
| Unit cell angles | 84.93, 87.83, 65.20 |
Refinement procedure
| Resolution | 45.642 - 2.300 |
| R-factor | 0.2237 |
| Rwork | 0.222 |
| R-free | 0.26020 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5ayv |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.815 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.350 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Number of reflections | 42722 | |
| <I/σ(I)> | 9.4 | 2.1 |
| Completeness [%] | 88.4 | 79.7 |
| Redundancy | 1.9 | 1.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293 | PEG 3350, 2-propanol, sodium acetate |
