8BX3
fragment-linked stabilizer for ERa - 14-3-3 interaction (1074372)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I24 |
| Synchrotron site | Diamond |
| Beamline | I24 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-02-28 |
| Detector | DECTRIS EIGER2 S 9M |
| Wavelength(s) | 0.976292 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 81.920, 112.508, 62.491 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.960 - 1.200 |
| R-factor | 0.1824 |
| Rwork | 0.182 |
| R-free | 0.18940 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.025 |
| Data reduction software | DIALS |
| Data scaling software | XDS |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.19.2-4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 41.810 | 1.220 |
| High resolution limit [Å] | 1.200 | 1.200 |
| Number of reflections | 90165 | 4411 |
| <I/σ(I)> | 12.5 | |
| Completeness [%] | 100.0 | |
| Redundancy | 12.7 | |
| CC(1/2) | 1.000 | 0.614 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.095 M HEPES (pH 7.3), PEG400 (26% (v/v)), 0.19 M CaCl2 and 5% (v/v) Glycerol |
