5IO5
Unliganded form of bovine beta-lactoglobulin, ambient pressure
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | OXFORD DIFFRACTION ENHANCE ULTRA |
| Temperature [K] | 298 |
| Detector technology | CCD |
| Collection date | 2008-12-12 |
| Detector | Nonius Kappa CCD |
| Wavelength(s) | 0.7 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 53.366, 53.366, 113.007 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 37.670 - 2.850 |
| R-factor | 0.2041 |
| Rwork | 0.199 |
| R-free | 0.29520 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3lbg |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.190 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.220 | 2.990 |
| High resolution limit [Å] | 2.790 | 2.790 |
| Rmerge | 0.097 | 0.488 |
| Number of reflections | 4831 | |
| <I/σ(I)> | 3.8 | 4.4 |
| Completeness [%] | 94.4 | 97.2 |
| Redundancy | 1.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 1.34 M citric sodium pH 7.5 |
