3FE9
Crystal structure of a pheromone binding protein from Apis mellifera with a serendipitous ligand soaked at pH 7.0
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-11-24 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.933 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 83.298, 83.909, 46.804 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.000 - 1.750 |
R-factor | 0.16238 |
Rwork | 0.161 |
R-free | 0.18689 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 2h8v |
RMSD bond length | 0.012 |
RMSD bond angle | 1.277 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | REFMAC (5.4.0077) |
Refinement software | REFMAC (5.4.0077) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.960 | 1.840 |
High resolution limit [Å] | 1.750 | 1.750 |
Rmerge | 0.087 | 0.484 |
Number of reflections | 16926 | |
<I/σ(I)> | 21.2 | 4.1 |
Completeness [%] | 99.9 | 100 |
Redundancy | 7.9 | 8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 293 | 1.7M ammonium sulfate, 0.1M sodium citrate, pH5.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |