4I95
Crystal structure of a Lipocalin-like protein (BACEGG_00036) from Bacteroides eggerthii DSM 20697 at 1.81 A resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2012-07-16 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | P 63 2 2 |
Unit cell lengths | 103.067, 103.067, 114.975 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 48.331 - 1.810 |
R-factor | 0.1753 |
Rwork | 0.174 |
R-free | 0.20390 |
Structure solution method | SAD |
RMSD bond length | 0.016 |
RMSD bond angle | 1.765 |
Data reduction software | XDS |
Data scaling software | XSCALE (March 15, 2012) |
Phasing software | SHELX |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 48.331 | 1.870 | |
High resolution limit [Å] | 1.810 | 3.890 | 1.810 |
Rmerge | 0.193 | 0.016 | 0.016 |
Number of reflections | 33477 | 3653 | 3053 |
<I/σ(I)> | 15.74 | 39 | 2.9 |
Completeness [%] | 100.0 | 99.8 | 100 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 277 | 1.0000M lithium chloride, 20.0000% polyethylene glycol 6000, 0.1M MES pH 6.0, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K |