6HR2
Crystal structure of PROTAC 2 in complex with the bromodomain of human SMARCA4 and pVHL:ElonginC:ElonginB
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-08-22 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.000 |
Spacegroup name | P 1 |
Unit cell lengths | 60.332, 61.678, 81.603 |
Unit cell angles | 69.43, 83.38, 86.42 |
Refinement procedure
Resolution | 39.800 - 1.760 |
R-factor | 0.216 |
Rwork | 0.216 |
R-free | 0.23600 |
RMSD bond length | 0.008 |
RMSD bond angle | 0.940 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.7) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.800 | 1.960 |
High resolution limit [Å] | 1.760 | 1.760 |
Number of reflections | 68052 | |
<I/σ(I)> | 12.1 | |
Completeness [%] | 89.4 | |
Redundancy | 2.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 277 | 20% (w/v) PEG1500, 0.1 M MIB Buffer, pH 6.0 |