2QO6
Crystal structure of the glycine 55 arginine mutant of zebrafish liver bile acid-binding protein complexed with cholic acid
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU300 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2005-05-09 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.5418 |
Spacegroup name | P 32 |
Unit cell lengths | 43.496, 43.496, 67.348 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 25.000 - 1.900 |
R-factor | 0.20657 |
Rwork | 0.205 |
R-free | 0.24458 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 2qo4 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.280 |
Data reduction software | AUTOMAR |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.940 |
High resolution limit [Å] | 1.870 | 1.870 |
Rmerge | 0.072 | 0.327 |
Number of reflections | 11016 | |
<I/σ(I)> | 6.6 | 1.7 |
Completeness [%] | 98.3 | 92.1 |
Redundancy | 3.5 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 298 | 20% PEG 4000, 20% isopropanol, 0.1M sodium citrate, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K |