5EK0
Human Nav1.7-VSD4-NavAb in complex with GX-936.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2013-12-16 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97625 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 169.420, 188.830, 171.130 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 26.590 - 3.530 |
R-factor | 0.2442 |
Rwork | 0.243 |
R-free | 0.27190 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3rvy |
RMSD bond length | 0.010 |
RMSD bond angle | 1.100 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | BUSTER (2.11.5) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 26.590 | 3.950 |
High resolution limit [Å] | 3.530 | 3.530 |
Rmerge | 0.149 | 0.800 |
Number of reflections | 33851 | |
<I/σ(I)> | 10.4 | 2 |
Completeness [%] | 99.6 | 100 |
Redundancy | 9 | 8.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.4 | 277 | 2.2 ammonium sulfate, 100 mM sodium citrate pH 5.4 |