6S98
Crystal structure of the catalytic domain of UBE2S WT.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-1 |
Synchrotron site | ESRF |
Beamline | MASSIF-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-04-23 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.968 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 44.812, 49.050, 71.926 |
Unit cell angles | 90.00, 106.03, 90.00 |
Refinement procedure
Resolution | 42.150 - 1.550 |
R-factor | 0.1626 |
Rwork | 0.161 |
R-free | 0.18390 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1zdn |
RMSD bond length | 0.013 |
RMSD bond angle | 1.341 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.150 | 1.605 |
High resolution limit [Å] | 1.550 | 1.550 |
Rmerge | 0.025 | 0.430 |
Rmeas | 0.036 | 0.608 |
Rpim | 0.025 | 0.430 |
Number of reflections | 43484 | 4292 |
<I/σ(I)> | 14.5 | 2.02 |
Completeness [%] | 99.4 | 98.89 |
Redundancy | 1.8 | |
CC(1/2) | 0.999 | 0.638 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 8.5 | 293 | 0.2 M sodium-acetate-trihydrate; 0.1 M Tris; 30% PEG4000 |