3GG6
Crystal structure of the NUDIX domain of human NUDT18
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 173 |
Detector technology | CCD |
Collection date | 2008-12-11 |
Detector | ADSC QUANTUM Q315r |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 31.660, 60.130, 76.090 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 21.801 - 2.100 |
R-factor | 0.1699 |
Rwork | 0.164 |
R-free | 0.22560 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2b0v |
RMSD bond length | 0.022 |
RMSD bond angle | 1.816 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 2.150 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.161 | 0.557 |
Number of reflections | 8985 | |
<I/σ(I)> | 4.1 | |
Completeness [%] | 99.8 | 99.8 |
Redundancy | 7.88 | 5.22 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.5 | 293 | Tri-sodium citrate dihydrate 0.1M pH 5.5, PEG3000 20% w/v, 2mM 2 deoxyguanosine, VAPOR DIFFUSION, SITTING DROP, temperature 293K |