5E9I
Crystal Structure of BAZ2B bromodomain in complex with fragment F60
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 5.2R |
| Synchrotron site | ELETTRA |
| Beamline | 5.2R |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-05-05 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.915 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 83.030, 96.037, 57.902 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.515 - 1.960 |
| R-factor | 0.1897 |
| Rwork | 0.188 |
| R-free | 0.21680 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.076 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 48.020 | 48.020 | 2.010 |
| High resolution limit [Å] | 1.960 | 8.980 | 1.960 |
| Rmerge | 0.037 | 0.013 | 0.348 |
| Rpim | 0.016 | 0.006 | 0.141 |
| Total number of observations | 107292 | 1259 | 8218 |
| Number of reflections | 16565 | ||
| <I/σ(I)> | 32 | 81 | 4.4 |
| Completeness [%] | 97.2 | 98.8 | 99.6 |
| Redundancy | 6.5 | 6 | 6.9 |
| CC(1/2) | 1.000 | 1.000 | 0.978 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 277 | PEG500MME (20%), PEG1000 (2%), PEG3350 (2%), PEG20000 (10%), MPD (2%) |
