5ABG
Structure of GH84 with ligand
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | P 2 21 21 |
Unit cell lengths | 51.531, 161.184, 223.980 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.442 - 2.000 |
R-factor | 0.2061 |
Rwork | 0.204 |
R-free | 0.23540 |
Structure solution method | OTHER |
Starting model (for MR) | NONE |
RMSD bond length | 0.003 |
RMSD bond angle | 0.776 |
Data reduction software | XDS |
Data scaling software | XDS |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.080 | 2.030 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.090 | |
Number of reflections | 126740 | |
<I/σ(I)> | 11.9 | 1.5 |
Completeness [%] | 99.6 | 99.7 |
Redundancy | 6.6 | 6.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |