7SDV
[T:Ag+:mC] Metal-mediated DNA base pair in a self-assembling rhombohedral lattice
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-07-18 |
| Detector | DECTRIS EIGER2 X 9M |
| Wavelength(s) | 1.0743 |
| Spacegroup name | H 3 |
| Unit cell lengths | 105.128, 105.128, 91.029 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 32.190 - 4.190 |
| R-factor | 0.241 |
| Rwork | 0.237 |
| R-free | 0.32170 |
| Structure solution method | SAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.939 |
| Data reduction software | autoPROC |
| Data scaling software | STARANISO |
| Phasing software | AutoSol |
| Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 64.469 | 4.328 |
| High resolution limit [Å] | 4.001 | 4.001 |
| Rpim | 3.354 | |
| Number of reflections | 2167 | 197 |
| <I/σ(I)> | 5.3 | 0.5 |
| Completeness [%] | 88.7 | 69.4 |
| Redundancy | 10.7 | |
| CC(1/2) | 0.999 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.8 | 293 | MOPS, Magnesium sulfate, Silver nitrate |
