4NDH
Human Aprataxin (Aptx) bound to DNA, AMP, and Zn - product complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-11-20 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 40.397, 117.082, 118.202 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 32.687 - 1.848 |
R-factor | 0.1642 |
Rwork | 0.163 |
R-free | 0.19640 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3szq |
RMSD bond length | 0.005 |
RMSD bond angle | 1.099 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.920 |
High resolution limit [Å] | 1.848 | 3.990 | 1.848 |
Rmerge | 0.063 | 0.034 | 0.436 |
Number of reflections | 48759 | ||
<I/σ(I)> | 10.2 | ||
Completeness [%] | 99.4 | 98.4 | 98.5 |
Redundancy | 3.8 | 3.6 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 8.5 | 277 | 100 mM Tris, 20% w/v PEG10000, pH 8.5, VAPOR DIFFUSION, temperature 277K |