5IW1
Crystal Structure of B4.2.3 T-Cell Receptor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X29A |
Synchrotron site | NSLS |
Beamline | X29A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-11-07 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.0809 |
Spacegroup name | P 31 |
Unit cell lengths | 96.112, 96.112, 167.578 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 48.056 - 3.001 |
R-factor | 0.243 |
Rwork | 0.240 |
R-free | 0.26750 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5ivx |
RMSD bond length | 0.002 |
RMSD bond angle | 0.608 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1690) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.100 | 3.100 |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.131 | 0.482 |
Number of reflections | 32680 | |
<I/σ(I)> | 12.6 | 1.8 |
Completeness [%] | 94.4 | 65.3 |
Redundancy | 5.4 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.8 | 291 | 16% PEG 4000, 0.1M TRIS, 0.2M Magnesium Chloride |