5TEZ
TCR F50 recgonizing M1-HLA-A2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 80 |
Detector technology | CCD |
Collection date | 2016-03-04 |
Detector | MARMOSAIC 325 mm CCD |
Wavelength(s) | 0.97945 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 66.266, 71.053, 100.693 |
Unit cell angles | 90.00, 96.22, 90.00 |
Refinement procedure
Resolution | 37.924 - 1.700 |
R-factor | 0.191 |
Rwork | 0.190 |
R-free | 0.22410 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1oga |
RMSD bond length | 0.042 |
RMSD bond angle | 1.637 |
Data reduction software | HKL-2000 |
Data scaling software | Aimless (0.5.17) |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 37.924 | 37.920 | 1.550 |
High resolution limit [Å] | 1.520 | 8.330 | 1.520 |
Rmerge | 0.351 | 0.055 | 8.812 |
Number of reflections | 136200 | ||
<I/σ(I)> | 5.6 | ||
Completeness [%] | 95.6 | 99 | 44.3 |
Redundancy | 6.6 | 7.1 | 3 |
CC(1/2) | 0.990 | 0.996 | 0.069 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 295 | PEG 3350, 0.1 M imidazole (pH 8.0), and 0.2 M sodium malonate |