3LQC
X-ray crystal structure of oxidized XRCC1 bound to DNA pol beta Palm thumb domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-09-01 |
Detector | RIGAKU SATURN 92 |
Wavelength(s) | 1.5418 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 75.240, 75.240, 126.160 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 24.628 - 2.349 |
R-factor | 0.192 |
Rwork | 0.189 |
R-free | 0.25000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1xna |
RMSD bond length | 0.006 |
RMSD bond angle | 0.920 |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.410 |
High resolution limit [Å] | 2.350 | 2.350 |
Rmerge | 0.122 | 0.517 |
Number of reflections | 17765 | 1270 |
<I/σ(I)> | 19.02 | 4.2 |
Completeness [%] | 99.8 | 99 |
Redundancy | 10.3 | 7.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 20-25% PEG 3350, 0.2-0.3M TRI-POTASSIUM CITRATE, PH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |