5T70
KIR3DL1 in complex with HLA-B*57:01 presenting TSNLQEQIGW
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 | 2012-04-04 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.954 |
| Spacegroup name | P 1 |
| Unit cell lengths | 51.726, 61.209, 65.186 |
| Unit cell angles | 96.04, 97.46, 108.72 |
Refinement procedure
| Resolution | 63.840 - 2.100 |
| R-factor | 0.1767 |
| Rwork | 0.174 |
| R-free | 0.22450 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3vh8 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.090 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.8.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 63.840 | 2.210 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.083 | 0.579 |
| Number of reflections | 39560 | |
| <I/σ(I)> | 12.7 | 2.4 |
| Completeness [%] | 91.4 | 91.7 |
| Redundancy | 3.8 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 298 | 16% PEG 3350, 2% tacsimate pH 5.0 and 0.1M tri-sodium citrate pH 5.6 |
