5F9I
Crystal Structure of rich-AT DNA 20mer
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-07-09 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.97949 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 60.647, 26.340, 76.434 |
| Unit cell angles | 90.00, 95.98, 90.00 |
Refinement procedure
| Resolution | 40.000 - 3.000 |
| R-factor | 0.22662 |
| Rwork | 0.226 |
| R-free | 0.25019 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.884 |
| Data reduction software | XDS (20141118) |
| Data scaling software | XDS (20141118) |
| Phasing software | MOLREP (11.4.03) |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 3.240 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmerge | 0.140 | 0.270 |
| Number of reflections | 5042 | |
| <I/σ(I)> | 6.91 | 2.45 |
| Completeness [%] | 98.8 | 99.9 |
| Redundancy | 5.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | Na Cacodylate pH 6.5, MgCl2 ,MPD 45% |
