6NO4
ADP bound to L227bF mutant ATP-grasp fold of Blastocystis hominis succinyl-CoA synthetase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-06-23 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.97949 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 79.252, 95.787, 68.873 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 68.873 - 2.240 |
R-factor | 0.2158 |
Rwork | 0.214 |
R-free | 0.25520 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | PHENIX (dev_3311) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 79.260 | 79.260 | 2.300 |
High resolution limit [Å] | 2.240 | 10.020 | 2.240 |
Rmerge | 0.083 | 0.054 | 0.788 |
Number of reflections | 25793 | ||
<I/σ(I)> | 9.9 | ||
Completeness [%] | 99.7 | 99.9 | 99.4 |
Redundancy | 6.4 | 5.4 | 6.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 294 | 12% w/v PEG3350, 100 mM MES, pH 6.0, 180 mM ammonium tartrate, pH 8 |