2XAQ
Crystal structure of LSD1-CoREST in complex with a tranylcypromine derivative (MC2584, 13b)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 120.102, 180.346, 235.928 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 99.960 - 3.200 |
R-factor | 0.24324 |
Rwork | 0.243 |
R-free | 0.26380 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.018 |
RMSD bond angle | 2.074 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 30.000 |
High resolution limit [Å] | 3.200 |
Rmerge | 0.120 |
Number of reflections | 42599 |
<I/σ(I)> | 9.2 |
Completeness [%] | 99.9 |
Redundancy | 5.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | SODIUM-POTASSIUM TARTRATE, ADA BUFFER PH 6.5 |