2O9S
The second SH3 domain from ponsin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE X11 |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | X11 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-06-01 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.8131 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 24.743, 36.562, 69.124 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.000 - 0.830 |
| R-factor | 0.1043 |
| R-free | 0.12140 |
| Structure solution method | MIR |
| Starting model (for MR) | 2o2w |
| RMSD bond length | 0.014 |
| RMSD bond angle | 0.030 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 0.850 |
| High resolution limit [Å] | 0.830 | 0.830 |
| Rmerge | 0.083 | 0.219 |
| Number of reflections | 56189 | |
| <I/σ(I)> | 22.7 | 8.6 |
| Completeness [%] | 93.0 | 91.5 |
| Redundancy | 7.1 | 6.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 292 | 0.5M KSCN, 0.1M Tris/HCl, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 292K |
