2PYW
Structure of A. thaliana 5-methylthioribose kinase in complex with ADP and MTR
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X8C |
| Synchrotron site | NSLS |
| Beamline | X8C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-08-29 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 162.460, 82.240, 91.080 |
| Unit cell angles | 90.00, 117.83, 90.00 |
Refinement procedure
| Resolution | 80.580 - 1.900 |
| R-factor | 0.16475 |
| Rwork | 0.163 |
| R-free | 0.19723 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2olc |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.380 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 80.580 | 1.970 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.045 | 0.175 |
| Number of reflections | 82470 | |
| <I/σ(I)> | 16.9 | 4.8 |
| Completeness [%] | 98.7 | 90.8 |
| Redundancy | 3.38 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 298 | 10% PEG8000, 0.1M sodium cacodylate, 0.2M magnesium acetate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
