7ZLR
Crystal structure of SOCS2:ElonginB:ElonginC in complex with compound 13
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-05-19 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.9763 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 56.112, 52.246, 77.458 |
| Unit cell angles | 90.00, 108.27, 90.00 |
Refinement procedure
| Resolution | 53.280 - 2.010 |
| R-factor | 0.2028 |
| Rwork | 0.200 |
| R-free | 0.25540 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | SBC |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.918 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 53.284 | 2.042 |
| High resolution limit [Å] | 2.007 | 2.007 |
| Rmerge | 0.202 | |
| Number of reflections | 24931 | 1306 |
| <I/σ(I)> | 7.3 | 1 |
| Completeness [%] | 86.9 | |
| Redundancy | 6.5 | |
| CC(1/2) | 0.989 | 0.316 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 100mM Tris-Bicine, PEG8K (9-14%), Ethylene glycol (26-20%) with seeding |
