2A2T
crystal structure of d(AAATATTT)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM16 |
| Synchrotron site | ESRF |
| Beamline | BM16 |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Wavelength(s) | 0.979433 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 147.623, 24.985, 82.139 |
| Unit cell angles | 90.00, 90.51, 90.00 |
Refinement procedure
| Resolution | 15.000 - 3.100 |
| R-factor | 0.27587 |
| Rwork | 0.272 |
| R-free | 0.35737 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.650 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0016) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 15.000 | 3.210 |
| High resolution limit [Å] | 3.100 | 3.100 |
| Number of reflections | 5712 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | MPD, manganes chloride, spermine, cacodylate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
Crystallization Reagents
| ID | crystal ID | solution ID | reagent name | concentration | details |
| 1 | 1 | 1 | MPD | ||
| 2 | 1 | 1 | manganes chloride | ||
| 3 | 1 | 1 | spermine | ||
| 4 | 1 | 1 | cacodylate | ||
| 5 | 1 | 1 | HOH | ||
| 6 | 1 | 2 | MPD | ||
| 7 | 1 | 2 | manganes chloride | ||
| 8 | 1 | 2 | cacodylate | ||
| 9 | 1 | 2 | HOH |
