3GSK
A Bulky Rhodium Complex Bound to an Adenosine-Adenosine DNA Mismatch
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL11-1 |
| Synchrotron site | SSRL |
| Beamline | BL11-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | MARMOSAIC 325 mm CCD |
| Wavelength(s) | 1.0046 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 48.337, 48.337, 69.505 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 20.271 - 1.600 |
| R-factor | 0.1859 |
| Rwork | 0.184 |
| R-free | 0.22740 |
| Structure solution method | SAD |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | SHELXD |
| Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.000 | 1.690 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.035 | 0.499 |
| Number of reflections | 22677 | |
| <I/σ(I)> | 26.7 | 2 |
| Completeness [%] | 99.5 | 98.9 |
| Redundancy | 7.9 | 4.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7 | 298 | 20 mM sodium cacodylate, 6 mM spermine, 4HCl,40 mM NaCl, 5% 2-methyl-2,4-pentanediol, pH 7, VAPOR DIFFUSION |
