2XAJ
Crystal structure of LSD1-CoREST in complex with (-)-trans-2- phenylcyclopropyl-1-amine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC QUANTUM 4 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 119.075, 179.782, 235.481 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 71.450 - 3.300 |
R-factor | 0.19923 |
Rwork | 0.199 |
R-free | 0.22701 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.015 |
RMSD bond angle | 1.689 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Refinement software | REFMAC (5.5.0090) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 30.000 |
High resolution limit [Å] | 3.300 |
Rmerge | 0.120 |
Number of reflections | 38325 |
<I/σ(I)> | 9.8 |
Completeness [%] | 99.9 |
Redundancy | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | SODIUM-POTASSIUM TARTRATE, ADA BUFFER PH 6.5 |