3CVI
How TCR-like antibody recognizes MHC-bound peptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2005-02-10 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.54 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 49.440, 60.860, 79.750 |
Unit cell angles | 90.00, 111.97, 90.00 |
Refinement procedure
Resolution | 20.020 - 1.800 |
Rwork | 0.219 |
R-free | 0.26400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1osp |
RMSD bond length | 0.009 |
RMSD bond angle | 1.520 |
Data reduction software | d*TREK |
Data scaling software | d*TREK (7.1SSI) |
Phasing software | PHASER |
Refinement software | CNS |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 20.020 | 20.020 | 1.860 |
High resolution limit [Å] | 1.800 | 3.860 | 1.800 |
Rmerge | 0.089 | 0.047 | 0.374 |
Total number of observations | 13273 | 10711 | |
Number of reflections | 40448 | ||
<I/σ(I)> | 4.5 | 11.9 | 1.3 |
Completeness [%] | 98.3 | 96.8 | 91.5 |
Redundancy | 3.06 | 3.13 | 2.87 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293 | 0.2 M (NH4)2SO4, 0.1 M NaOAc, pH 4.6 containing 25% w/v polyethylene glycol 4000, VAPOR DIFFUSION, HANGING DROP, temperature 293K |