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 |