5T3O
Crystal structure of the Phosphorybosylpyrophosphate synthetase II from Thermus thermophilus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-06-27 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.8 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 115.970, 115.970, 207.990 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 64.390 - 2.200 |
R-factor | 0.22875 |
Rwork | 0.227 |
R-free | 0.25443 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1dkr |
RMSD bond length | 0.009 |
RMSD bond angle | 1.453 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | BALBES |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 77.400 | 2.320 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.091 | |
Number of reflections | 72677 | |
<I/σ(I)> | 4.1075 | 2.01 |
Completeness [%] | 100.0 | 99.96 |
Redundancy | 11.43 | 6.55 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | LIQUID DIFFUSION | 293 | 0.8M SA |