8FJ6
LSD1-CoREST in complex with T108, long soaking
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 | 2021-02-02 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.96546 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 119.036, 179.360, 233.231 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.570 - 2.630 |
R-factor | 0.2195 |
Rwork | 0.219 |
R-free | 0.24050 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.012 |
RMSD bond angle | 1.629 |
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] | 48.570 | 2.680 |
High resolution limit [Å] | 2.630 | 2.630 |
Rmerge | 0.095 | 3.206 |
Rmeas | 0.108 | 3.705 |
Rpim | 0.050 | 1.812 |
Total number of observations | 313206 | 16722 |
Number of reflections | 73884 | 4376 |
<I/σ(I)> | 9.9 | 0.5 |
Completeness [%] | 99.4 | |
Redundancy | 4.2 | 3.8 |
CC(1/2) | 0.998 | 0.091 |
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 |