5A9F
Crystal structure of the Helicase domain of human DNA polymerase theta in complex with ADP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-07-30 |
Detector | DECTRIS PILATUS 2M |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 115.767, 133.740, 162.697 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.111 - 3.200 |
R-factor | 0.2287 |
Rwork | 0.226 |
R-free | 0.27310 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5aga |
RMSD bond length | 0.005 |
RMSD bond angle | 1.137 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.100 | 3.420 |
High resolution limit [Å] | 3.200 | 3.200 |
Rmerge | 0.050 | 0.720 |
Number of reflections | 20899 | |
<I/σ(I)> | 14.9 | 1.8 |
Completeness [%] | 98.8 | 99.6 |
Redundancy | 3.4 | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 19% PEG 3350, 0.2M POTASSIUM CITRATE TRIBASIC |