3R03
The crystal structure of NUDIX hydrolase from Rhodospirillum rubrum
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X25 |
Synchrotron site | NSLS |
Beamline | X25 |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2011-01-01 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9795 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 107.466, 107.466, 50.312 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.534 - 2.491 |
R-factor | 0.2368 |
Rwork | 0.231 |
R-free | 0.28560 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 0.969 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SOLVE |
Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.580 |
High resolution limit [Å] | 2.490 | 2.490 |
Rmerge | 0.110 | 0.410 |
Number of reflections | 11862 | |
<I/σ(I)> | 27.1 | 5.7 |
Completeness [%] | 99.1 | 99.9 |
Redundancy | 22 | 21 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 293 | 0.1 M Sodium acetate trihydarate pH 4.6, 8% PEG 4000, 10 mM ATP, VAPOR DIFFUSION, SITTING DROP, temperature 293K |