8C13
Crystal structure of pVHL:ElonginC:ElonginB complex bound to PROTAC JW48
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-05-15 |
Detector | DECTRIS PILATUS 2M-F |
Wavelength(s) | 0.999987 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 73.797, 60.787, 97.228 |
Unit cell angles | 90.00, 100.58, 90.00 |
Refinement procedure
Resolution | 47.833 - 2.300 |
Rwork | 0.223 |
R-free | 0.26120 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.002 |
RMSD bond angle | 0.756 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0352) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.833 | 2.380 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.111 | 1.207 |
Rmeas | 0.121 | 1.299 |
Rpim | 0.046 | 0.477 |
Total number of observations | 13682 | |
Number of reflections | 18781 | 1874 |
<I/σ(I)> | 9.9 | 1.8 |
Completeness [%] | 99.1 | |
Redundancy | 7 | 7.3 |
CC(1/2) | 0.997 | 0.752 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | 18% PEG 3350, HEPES pH7 |