3QVG
XRCC1 bound to DNA ligase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-01-25 |
Detector | RIGAKU SATURN 92 |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 38.140, 61.470, 163.670 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.061 - 2.260 |
R-factor | 0.2023 |
Rwork | 0.199 |
R-free | 0.26960 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | pdb entries 3PC7 3pc6 |
RMSD bond length | 0.003 |
RMSD bond angle | 0.604 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.6.4_486) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 35.000 | 35.000 | 2.340 |
High resolution limit [Å] | 2.260 | 4.870 | 2.260 |
Rmerge | 0.071 | 0.056 | 0.261 |
Number of reflections | 18358 | ||
<I/σ(I)> | 20.9 | ||
Completeness [%] | 97.5 | 99.7 | 80.4 |
Redundancy | 6.3 | 6.4 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 277 | 30 % PEG4000, 0.1 M Tris, 0.2 M NaAcetate, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |