3NED
mRouge
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-11-28 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.807, 42.760, 61.203 |
| Unit cell angles | 90.00, 112.35, 90.00 |
Refinement procedure
| Resolution | 56.600 - 0.950 |
| R-factor | 0.1346 |
| Rwork | 0.133 |
| R-free | 0.15691 |
| Structure solution method | AB INITIO PHASING |
| RMSD bond length | 0.026 |
| RMSD bond angle | 2.431 |
| Data reduction software | iMOSFLM |
| Phasing software | ACORN |
| Refinement software | REFMAC (5.5.0088) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 56.700 |
| High resolution limit [Å] | 0.950 |
| Rmerge | 0.121 |
| Number of reflections | 135356 |
| <I/σ(I)> | 9.7 |
| Completeness [%] | 91.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 298 | 200 mM ammonium acetate, 100 mM Bis-Tris, pH 6.5, and 25% (w/v) polyethylene glycol 3350, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
