6B57
tudor in complex with ligand
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-01-17 |
Detector | RIGAKU SATURN A200 |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 47.070, 72.660, 130.700 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 65.350 - 1.930 |
R-factor | 0.208 |
Rwork | 0.206 |
R-free | 0.23400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5j39 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.080 |
Data reduction software | Aimless (0.5.32) |
Data scaling software | autoPROC |
Phasing software | PHASER |
Refinement software | BUSTER (2.10.2) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 65.350 | 65.350 | 1.980 |
High resolution limit [Å] | 1.930 | 9.060 | 1.930 |
Rmerge | 0.068 | 0.035 | 0.825 |
Rmeas | 0.075 | 0.038 | 0.916 |
Rpim | 0.029 | 0.016 | 0.387 |
Total number of observations | 217894 | 2235 | 11705 |
Number of reflections | 34211 | ||
<I/σ(I)> | 15.2 | 34.7 | 1.9 |
Completeness [%] | 99.5 | 98.4 | 97.4 |
Redundancy | 6.4 | 5.7 | 5.2 |
CC(1/2) | 0.998 | 0.997 | 0.647 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 20% (w/v) PEG-3350, 0.2 M ammonium formate |