3W5O
Crystal Structure of Human DNA ligase IV
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-11-19 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9840 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 68.290, 104.360, 120.040 |
| Unit cell angles | 90.00, 94.08, 90.00 |
Refinement procedure
| Resolution | 47.835 - 2.840 |
| R-factor | 0.1961 |
| Rwork | 0.194 |
| R-free | 0.24550 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3w1b |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.252 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.8.1_1168)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 200.000 | 2.910 |
| High resolution limit [Å] | 2.840 | 2.840 |
| Rmerge | 0.097 | 0.568 |
| Number of reflections | 39757 | |
| <I/σ(I)> | 10.1 | 2.1 |
| Completeness [%] | 99.4 | 99.9 |
| Redundancy | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.7 | 291 | 2M ammonium sulfate, 10mM YCl, 100mM MES, pH 5.7, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
