7CD9
Crystal Structure of SETDB1 tudor domain in complexed with Compound 6
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-06-18 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97849 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 56.794, 74.938, 59.329 |
Unit cell angles | 90.00, 90.73, 90.00 |
Refinement procedure
Resolution | 29.662 - 1.600 |
R-factor | 0.1932 |
Rwork | 0.192 |
R-free | 0.22280 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6bhd |
RMSD bond length | 0.010 |
RMSD bond angle | 1.114 |
Data reduction software | HKL-3000 |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.630 |
High resolution limit [Å] | 1.600 | 1.600 |
Number of reflections | 64717 | 3196 |
<I/σ(I)> | 30.257 | |
Completeness [%] | 98.6 | |
Redundancy | 6.9 | |
CC(1/2) | 0.996 | 0.996 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289 | 0.2 M Sodium citrate tribasic dihydrate 20% PEG3350 PH 8.3 |