6G9Q
Ternary complex of P14 TCR with murine MHC class I H-2 Db in complex with self-antigen derived from dopamine monooxygenase.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-04-04 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9795 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 256.383, 46.622, 90.059 |
| Unit cell angles | 90.00, 94.20, 90.00 |
Refinement procedure
| Resolution | 50.420 - 1.890 |
| R-factor | 0.19028 |
| Rwork | 0.187 |
| R-free | 0.24752 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1S7U.pdb |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.173 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.500 | 1.990 |
| High resolution limit [Å] | 1.890 | 1.890 |
| Rmerge | 0.040 | 0.580 |
| Number of reflections | 80434 | 8616 |
| <I/σ(I)> | 16 | 1.6 |
| Completeness [%] | 93.9 | 69.6 |
| Redundancy | 3 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | Tris HCl pH 8.0 PEG 6000 |
