4H67
Crystal structure of HMP synthase Thi5 from S. cerevisiae
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-07-04 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.98011 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 78.790, 188.460, 101.670 |
| Unit cell angles | 90.00, 112.51, 90.00 |
Refinement procedure
| Resolution | 49.142 - 2.700 |
| R-factor | 0.2087 |
| Rwork | 0.207 |
| R-free | 0.24690 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4h65 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.435 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | CCP4 |
| Refinement software | PHENIX ((phenix.refine: 1.7.3_928)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.142 | 2.770 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Rmerge | 0.056 | 0.627 |
| Number of reflections | 71456 | |
| <I/σ(I)> | 13.68 | 1.77 |
| Completeness [%] | 95.1 | 96.1 |
| Redundancy | 1.92 | 1.92 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 291.15 | 0.2 M lithium sulfate monohydrate, 0.1 M Bis-Tris, pH 5.5, 25% PEG3350, VAPOR DIFFUSION, SITTING DROP, temperature 291.15K |
