8BOX
LSD1-CoREST in complex with AW4 and SNAG peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID30B |
| Synchrotron site | ESRF |
| Beamline | ID30B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-02-06 |
| Detector | DECTRIS EIGER2 X 9M |
| Wavelength(s) | 0.96546 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 118.978, 177.894, 234.307 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.340 - 2.820 |
| R-factor | 0.2198 |
| Rwork | 0.220 |
| R-free | 0.22870 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2v1d |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.549 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.18.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.340 | 2.890 |
| High resolution limit [Å] | 2.820 | 2.820 |
| Rmerge | 0.086 | 1.883 |
| Rmeas | 0.098 | 2.148 |
| Rpim | 0.045 | 1.010 |
| Total number of observations | 255787 | 18492 |
| Number of reflections | 59799 | 4407 |
| <I/σ(I)> | 11.8 | 0.8 |
| Completeness [%] | 99.6 | |
| Redundancy | 4.3 | 4.2 |
| CC(1/2) | 0.998 | 0.334 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 1.2 Na/K Tartrate, 100 mM ADA pH 6.5 |
