5L3E
LSD1-CoREST1 in complex with quinazoline-derivative reversible inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-02-20 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 1.000 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 116.570, 178.400, 233.780 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 98.570 - 2.800 |
| R-factor | 0.20094 |
| Rwork | 0.200 |
| R-free | 0.22447 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2v1d |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.789 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 98.570 | 2.870 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.134 | 1.377 |
| Number of reflections | 60074 | |
| <I/σ(I)> | 8.3 | 1.1 |
| Completeness [%] | 99.8 | 99.4 |
| Redundancy | 5 | 5.1 |
| CC(1/2) | 0.994 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 1.3 M Na/K Tartrate, 100 mM ADA |
