8DIW
Crystal structure of NavAb E96P as a basis for the human Nav1.7 Inherited Erythromelalgia S211P mutation
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.1 |
Synchrotron site | ALS |
Beamline | 8.2.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2020-11-12 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0 |
Spacegroup name | I 4 2 2 |
Unit cell lengths | 123.120, 123.120, 191.551 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 41.960 - 3.110 |
R-factor | 0.2271 |
Rwork | 0.225 |
R-free | 0.27230 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6mwa |
RMSD bond length | 0.003 |
RMSD bond angle | 0.680 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.150 |
High resolution limit [Å] | 3.100 | 3.100 |
Rmerge | 0.121 | 1.227 |
Rpim | 0.054 | 0.534 |
Number of reflections | 13391 | 619 |
<I/σ(I)> | 10.7 | 0.79 |
Completeness [%] | 98.2 | 90.1 |
Redundancy | 5.1 | 4.6 |
CC(1/2) | 0.990 | 0.517 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.4 | 277 | 1.7-1.8 M Ammonium Sulfate 0.1 M Sodium Citrate pH 5.4 |