3JRZ
CcdBVfi-FormII-pH5.6
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 | 2006-10-12 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.8162 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 58.506, 43.624, 37.489 |
| Unit cell angles | 90.00, 110.01, 90.00 |
Refinement procedure
| Resolution | 18.776 - 1.700 |
| R-factor | 0.1692 |
| Rwork | 0.168 |
| R-free | 0.19890 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3jsc |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.395 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.900 | 1.760 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.040 | 0.237 |
| Number of reflections | 9956 | |
| <I/σ(I)> | 22.98 | 8 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 6.31 | 6.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 293 | 100mM sodium citrate pH5.6, 2% polyethyleneimine, 500mM NaCl, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
