3WUW
KIR3DL1 in complex with HLA-B*57:01.I80T
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-08-12 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9546 |
Spacegroup name | P 1 |
Unit cell lengths | 52.058, 61.494, 66.356 |
Unit cell angles | 94.66, 99.58, 109.14 |
Refinement procedure
Resolution | 40.000 - 2.000 |
R-factor | 0.2005 |
Rwork | 0.198 |
R-free | 0.23880 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3vh8 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.293 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.7.3_928)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.472 | 2.110 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.120 | 0.660 |
Number of reflections | 49831 | |
<I/σ(I)> | 8.4 | 2.8 |
Completeness [%] | 98.2 | 97.2 |
Redundancy | 3.9 | 3.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 293 | 16% PEG3350, 2% tacsimate(pH 5.0), 0.1M tri-sodium citrate pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K |