1QVJ
structure of NUDT9 complexed with ribose-5-phosphate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.1 |
Synchrotron site | ALS |
Beamline | 5.0.1 |
Temperature [K] | 170 |
Detector technology | CCD |
Collection date | 2002-09-20 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.00 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 78.900, 87.455, 120.308 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 * - 1.900* |
Rwork | 0.212 |
R-free | 0.24300 * |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1q33 |
RMSD bond length | 0.005 * |
RMSD bond angle | 1.233 * |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 * | 1.980 |
High resolution limit [Å] | 1.900 * | 1.910 |
Rmerge | 0.043 * | 0.311 * |
Total number of observations | 171127 * | |
Number of reflections | 31006 * | |
<I/σ(I)> | 35.4 | 4.4 |
Completeness [%] | 94.8 | 88.9 |
Redundancy | 5.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 * | 298 | Ammonium sulfate, magnisum chloride, trisHCl, pH 8, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 20 (mg/ml) | |
2 | 1 | reservoir | Tris-HCl | 25 (mM) | pH8.5 |
3 | 1 | reservoir | EDTA | 1 (mM) | |
4 | 1 | reservoir | dithiothreitol | 10 (mM) | |
5 | 1 | reservoir | 20 (mM) | ||
6 | 1 | reservoir | 150 (mM) |