5K06
Recombinant bovine beta-lactoglobulin with uncleaved N-terminal methionine (rBlgB)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | MAX II BEAMLINE I911-3 |
| Synchrotron site | MAX II |
| Beamline | I911-3 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-05-25 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 1.00 |
| Spacegroup name | P 64 2 2 |
| Unit cell lengths | 106.651, 106.651, 59.312 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 9.980 - 2.500 |
| R-factor | 0.22881 |
| Rwork | 0.213 |
| R-free | 0.32372 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1beb |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.676 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 9.980 | 2.540 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.073 | 0.228 |
| Number of reflections | 7101 | |
| <I/σ(I)> | 64.7 | 16.1 |
| Completeness [%] | 99.6 | 100 |
| Redundancy | 19.7 | 20.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 3.0 M (NH4)2SO4 solution in 0.2 M Tris-HCl buffer, pH from 7.8 to 8.8 |
