5NMT

Dimer structure of Sortilin ectodomain crystal form 1, 2.3A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-03-30
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.99998
Spacegroup name	P 21 21 21
Unit cell lengths	97.020, 131.130, 154.630
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	69.637 - 2.300
R-factor	0.2056
Rwork	0.205
R-free	0.23390
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3f6k
RMSD bond length	0.003
RMSD bond angle	0.633
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.11_2567: ???))

Data quality characteristics

	Overall
Low resolution limit [Å]	69.640
High resolution limit [Å]	2.300
Rmerge	0.103
Rmeas	0.115
Rpim	0.061
Number of reflections	87510
<I/σ(I)>	9.8
Completeness [%]	99.4
Redundancy	6.3
CC(1/2)	0.996

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.2	291	0.18 M Magnesium formate dihydrate pH 7.0, 18 % PEG 3350 (w/v), 10 mM TCEP hydrochloride