5SVP
Anomalous sulfur signal reveals the position of agonist 2-methylthio-ATP bound to the ATP-gated human P2X3 ion channel in the desensitized state
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-03-05 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 1.54980 |
Spacegroup name | P 21 3 |
Unit cell lengths | 172.930, 172.930, 172.930 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.962 - 3.298 |
R-factor | 0.2037 |
Rwork | 0.203 |
R-free | 0.22680 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.003 |
RMSD bond angle | 0.731 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10_2155: ???)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 3.298 |
Number of reflections | 50272 |
<I/σ(I)> | 11.75 |
Completeness [%] | 99.9 |
Redundancy | 5.82 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277.15 | 21% PEG 400, 100 mM Tris, pH 8.0, 325 mM Sodium Acetate, 100 mM NaCl |