8DIV

Crystal structure of NavAb I22V as a basis for the human Nav1.7 Inherited Erythromelalgia I136V 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	2009-03-07
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0
Spacegroup name	I 4 2 2
Unit cell lengths	124.578, 124.578, 190.927
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.970 - 2.540
R-factor	0.2013
Rwork	0.199
R-free	0.23700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3rvy
RMSD bond length	0.009
RMSD bond angle	1.071
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	2.570
High resolution limit [Å]	2.530	2.530
Rmerge	0.156	0.844
Rpim	0.045	0.360
Number of reflections	22384	415
<I/σ(I)>	13.3	0.43
Completeness [%]	87.6	33.3
Redundancy	11.5	3.6
CC(1/2)	1.000	0.886

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5	277	1.7-1.8 M Ammonium sulfate 0.1 M Sodium Citrate pH 5.0