6DBK
Tyk2 with compound 8
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-10-19 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.00 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 36.483, 73.139, 103.026 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 59.640 - 2.000 |
| R-factor | 0.203 |
| Rwork | 0.201 |
| R-free | 0.24890 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.110 |
| Data scaling software | SCALA (3.3.16) |
| Refinement software | BUSTER (2.11.2) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 103.026 | 103.026 | 2.110 |
| High resolution limit [Å] | 2.000 | 6.320 | 2.000 |
| Rmerge | 0.033 | 0.336 | |
| Rmeas | 0.070 | 0.038 | 0.442 |
| Rpim | 0.028 | 0.016 | 0.236 |
| Total number of observations | 108957 | ||
| Number of reflections | 19090 | 706 | 2618 |
| <I/σ(I)> | 17.8 | 16.6 | 2.3 |
| Completeness [%] | 98.5 | 99.4 | 94.9 |
| Redundancy | 5.7 | 5.6 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 0.1 M bis-tris pH 5.5, 0.25 M NaCl, 10 mM TCEP, 27-33% PEG-3350 |
