5L6I
Uba1 in complex with Ub-MLN4924 covalent adduct
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-05-04 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9184 |
Spacegroup name | P 2 21 21 |
Unit cell lengths | 72.500, 191.890, 230.197 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.760 |
R-factor | 0.17643 |
Rwork | 0.174 |
R-free | 0.21966 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4nnj |
RMSD bond length | 0.013 |
RMSD bond angle | 1.664 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | |
High resolution limit [Å] | 2.760 | 2.760 |
Number of reflections | 82916 | |
<I/σ(I)> | 11.2 | |
Completeness [%] | 99.0 | |
Redundancy | 5.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 0.2M lithium sulfate, 0.1M bis-tris, 15% peg 3350 |