8BYF
fragment-linked stabilizer for ERa - 14-3-3 interaction (1047455)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | RIGAKU MICROMAX-003 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-07-26 |
| Detector | DECTRIS PILATUS 200K |
| Wavelength(s) | 1.541870 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 81.787, 112.194, 62.391 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 34.200 - 1.650 |
| R-factor | 0.1703 |
| Rwork | 0.169 |
| R-free | 0.20240 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.030 |
| 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] | 66.090 | 1.680 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Number of reflections | 33440 | 1045 |
| <I/σ(I)> | 14.4 | |
| Completeness [%] | 95.8 | |
| Redundancy | 5.7 | |
| CC(1/2) | 0.998 | 0.615 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.095 M HEPES (pH 7.1), PEG400 (24% (v/v)), 0.19 M CaCl2 and 5% (v/v) Glycerol |
