3BYT
A complex between a variant of staphylococcal enterotoxin C3 and the variable domain of the murine T cell receptor beta chain 8.2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X12B |
Synchrotron site | NSLS |
Beamline | X12B |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-09-21 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.0722 |
Spacegroup name | P 1 |
Unit cell lengths | 63.157, 70.638, 98.843 |
Unit cell angles | 74.78, 75.16, 88.26 |
Refinement procedure
Resolution | 30.000 - 2.300 |
R-factor | 0.228 |
Rwork | 0.226 |
R-free | 0.27800 |
RMSD bond length | 0.038 |
RMSD bond angle | 2.870 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 2.000 |
Rmerge | 0.047 |
Number of reflections | 92210 |
Completeness [%] | 90.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 20% PEG 3350, 0.2 M tri-ammonium citrate pH 7.0, 0.3 % dioxane, VAPOR DIFFUSION, HANGING DROP, temperature 298K |