6VOV
Crystal structure of Syk in complex with GS-9876
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 5.0.2 |
| Synchrotron site | ALS |
| Beamline | 5.0.2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-09-13 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1 |
| Spacegroup name | P 1 |
| Unit cell lengths | 39.973, 42.050, 87.613 |
| Unit cell angles | 81.02, 90.33, 79.25 |
Refinement procedure
| Resolution | 35.260 - 1.950 |
| R-factor | 0.2202 |
| Rwork | 0.217 |
| R-free | 0.26750 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1xba |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.309 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.990 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.057 | |
| Rmeas | 0.479 | |
| Number of reflections | 85949 | 1851 |
| <I/σ(I)> | 13.8 | |
| Completeness [%] | 94.6 | |
| Redundancy | 2.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 20% PEG 3350, 100mM Tris pH 8.5 |
