4WFV
Bovine allergen Bos d 2 in the monoclinic space group C2.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-06-15 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.011 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 125.940, 36.590, 36.470 |
Unit cell angles | 90.00, 95.86, 90.00 |
Refinement procedure
Resolution | 25.603 - 1.400 |
R-factor | 0.1971 |
Rwork | 0.196 |
R-free | 0.21350 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1bj7 |
RMSD bond length | 0.006 |
RMSD bond angle | 1.081 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | PHENIX ((phenix.refine: 1.7_650)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.500 |
High resolution limit [Å] | 1.400 | 1.400 |
Rmerge | 0.044 | 0.368 |
Number of reflections | 31792 | |
<I/σ(I)> | 22.3 | 4.2 |
Completeness [%] | 96.9 | 88.8 |
Redundancy | 3.5 | 2.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.4 | 293 | 2.5 M 1,6-hexanediol, 0.1 M sodium citrate |