3SKN
Crystal structure of the RL42 TCR unliganded
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-07-08 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.954 |
Spacegroup name | P 1 |
Unit cell lengths | 74.970, 77.810, 99.640 |
Unit cell angles | 69.35, 72.20, 83.33 |
Refinement procedure
Resolution | 45.492 - 2.900 |
R-factor | 0.1989 |
Rwork | 0.194 |
R-free | 0.29170 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1kgc |
RMSD bond length | 0.005 |
RMSD bond angle | 0.918 |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.6.1_357) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 100.000 | 100.000 | 3.000 |
High resolution limit [Å] | 2.900 | 10.000 | 2.900 |
Rmerge | 0.094 | 0.041 | 0.577 |
Number of reflections | 43561 | 1062 | 4233 |
<I/σ(I)> | 11.98 | 30.74 | 2.41 |
Completeness [%] | 97.7 | 96.7 | 97.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 277 | 0.1M magnesium formate, 13% PEG 3350, pH 8, vapor diffusion, hanging drop, temperature 277K |