4L29
Structure of wtMHC class I with NY-ESO1 double mutant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2013-04-05 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0716 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 101.570, 313.360, 314.460 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 53.800 - 3.090 |
| R-factor | 0.17208 |
| Rwork | 0.171 |
| R-free | 0.20054 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.159 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | REFMAC (5.5.0109) |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 53.880 | 3.270 |
| High resolution limit [Å] | 3.090 | 3.090 |
| Rmerge | 0.192 | 0.010 |
| Number of reflections | 182537 | |
| <I/σ(I)> | 9.3 | 2.2 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 5.8 | 5.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 1.9 M ammonium sulphate, 2% PEG 6K, 100 mM Tris-HCl, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
