6SLV
Fragment AZ-013 binding at the p53pT387/14-3-3 sigma interface
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | RIGAKU MICROMAX-003 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-10-14 |
| Detector | DECTRIS PILATUS 200K |
| Wavelength(s) | 1.541870 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 82.322, 112.398, 62.672 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.840 - 1.900 |
| Rwork | 0.188 |
| R-free | 0.21840 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5moc |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.010 |
| Data reduction software | DIALS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 41.840 | 1.968 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.052 | 0.184 |
| Rmeas | 0.074 | 0.260 |
| Number of reflections | 23310 | 2300 |
| <I/σ(I)> | 10.31 | 2.98 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 2 | |
| CC(1/2) | 0.996 | 0.916 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 277 | 0.1M Hepes, pH7.5, 27%PEG, 5% Glycerol, 0.2M Calcium Chloride, 2mM DTT |
