8GHI
Crystal structure of Staphylococcus aureus Lysophosphatidylglycerol phospholipase D
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-10-22 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.0 |
Spacegroup name | I 4 2 2 |
Unit cell lengths | 108.032, 108.032, 139.710 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.200 - 2.400 |
R-factor | 0.2258 |
Rwork | 0.225 |
R-free | 0.24940 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.002 |
RMSD bond angle | 0.468 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.660 | 2.450 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.119 | 1.041 |
Number of reflections | 15817 | 1014 |
<I/σ(I)> | 7.4 | 1.1 |
Completeness [%] | 95.7 | 99.7 |
Redundancy | 4.7 | 5.4 |
CC(1/2) | 0.989 | 0.447 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | Phosphate-citrate, sodium dihydrogen phosphate, dipotassium hydrogen phosphate |