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 |
