4DY8
Interactions of Mn2+ with a non-self-complementary Z-type DNA duplex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2008-09-28 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 65 |
| Unit cell lengths | 35.213, 35.213, 44.452 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 25.150 - 1.760 |
| R-factor | 0.22741 |
| Rwork | 0.225 |
| R-free | 0.26150 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 2.341 |
| Data reduction software | AUTOMAR |
| Data scaling software | SCALA |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.820 |
| High resolution limit [Å] | 1.760 | 1.760 |
| Rmerge | 0.110 | 0.340 |
| Number of reflections | 3133 | |
| <I/σ(I)> | 4.17 | 1.1 |
| Completeness [%] | 97.4 | 100 |
| Redundancy | 3.86 | 3.98 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 50% methyl pentane diol, VAPOR DIFFUSION, HANGING DROP, temperature 293K, pH 7.0 |
