9BL3
KIR3DL1*114 in complex with HLA-B*57:03 presenting the AW10 peptide
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 | PIXEL |
| Collection date | 2022-04-21 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.953659 |
| Spacegroup name | P 1 |
| Unit cell lengths | 51.769, 60.784, 65.042 |
| Unit cell angles | 95.56, 98.16, 109.02 |
Refinement procedure
| Resolution | 48.100 - 2.000 |
| R-factor | 0.1947 |
| Rwork | 0.193 |
| R-free | 0.22890 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.896 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.100 | 2.050 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.054 | 0.463 |
| Number of reflections | 48382 | 3548 |
| <I/σ(I)> | 12.9 | 2.9 |
| Completeness [%] | 97.6 | 96.9 |
| Redundancy | 3.5 | |
| CC(1/2) | 0.998 | 0.850 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 294 | 16% PEG 3350, 2% tacsimate pH 5.0, 0.1 M tri-sodium citrate pH 5.6 |
