4LTG
Dehydration/Rehydration of a Nucleic Acid system containing a Polypyridyl Ruthenium Complex at 74% relative humidity (2/7)
Replaces: 3S80Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 298 |
| Detector technology | PIXEL |
| Collection date | 2012-12-13 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.8266 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 44.300, 44.300, 27.550 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 31.320 - 1.180 |
| R-factor | 0.09035 |
| Rwork | 0.089 |
| R-free | 0.11302 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3S80 |
| RMSD bond length | 0.022 |
| RMSD bond angle | 3.143 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 31.320 | 1.210 |
| High resolution limit [Å] | 1.180 | 1.180 |
| Number of reflections | 8969 | |
| Completeness [%] | 95.5 | 97.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.3 | 293 | 1ul 1mM d(TCGGCGCCGA)2, 1ul 4mM lambda-[Ru(TAP)2(dppz)]2+, 6ul 12mM spermine, 10% MPD, 40mM sodium cacodylate, 80mM KCl, 20mM BaCl2. Equilibriated against 1ml 35% MPD, pH 6.3, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
