5FSU
Crystal structure of Trypanosoma brucei macrodomain (crystal form 1)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-05-03 |
Detector | DECTRIS PIXEL |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 77.140, 77.140, 427.450 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 19.750 - 1.950 |
R-factor | 0.19042 |
Rwork | 0.189 |
R-free | 0.21912 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4iqy |
RMSD bond length | 0.011 |
RMSD bond angle | 1.430 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.000 |
High resolution limit [Å] | 1.950 | 1.950 |
Rmerge | 0.090 | |
Number of reflections | 56483 | |
<I/σ(I)> | 16.9 | 1.8 |
Completeness [%] | 99.7 | 99.7 |
Redundancy | 15.1 | 15.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 0.2 M SODIUM SULFATE, 0.1 M BIS-TRIS PROPANE PH 7.5, 20 % W/V PEG 3350 |