8ODS
Phosphate-Binding Protein (PstS) from Xanthomonas citri pv. citri A306 bound to phosphate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-05-03 |
Detector | DECTRIS PILATUS3 2M |
Wavelength(s) | 0.873128 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 43.370, 73.137, 99.165 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 41.040 - 1.909 |
R-factor | 0.2071 |
Rwork | 0.205 |
R-free | 0.25020 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 0.980 |
Data reduction software | XDS (Jan 10, 2022) |
Data scaling software | XSCALE (Jan 10, 2022) |
Phasing software | BALBES |
Refinement software | BUSTER (2.10.4) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.040 | 1.977 |
High resolution limit [Å] | 1.909 | 1.909 |
Rmerge | 0.098 | 0.415 |
Rmeas | 0.100 | 0.467 |
Rpim | 0.034 | 0.206 |
Number of reflections | 24939 | 2201 |
<I/σ(I)> | 14.73 | 3.01 |
Completeness [%] | 97.6 | 87.58 |
Redundancy | 8.6 | 4.8 |
CC(1/2) | 0.996 | 0.921 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 296.15 | Tris-HCl (pH 8.0), 50 mM KCl, 20% PEG 6000, 20 mg/ml protein |