9NWH

Long-wavelength SAD Crystal Structure of the Third Immunoglobulin-Like Domain of Human Muscle-Specific Kinase (MuSK)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-10-15
Detector	DECTRIS PILATUS 2M
Wavelength(s)	2.075
Spacegroup name	P 1 21 1
Unit cell lengths	79.162, 49.527, 143.758
Unit cell angles	90.00, 92.21, 90.00

Refinement procedure

Resolution	47.880 - 2.800
R-factor	0.2406
Rwork	0.239
R-free	0.26760
Structure solution method	SAD
RMSD bond length	0.008
RMSD bond angle	0.994
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	SHELXCD
Refinement software	PHENIX ((1.20_4459: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.530	2.950
High resolution limit [Å]	2.800	2.800
Rmerge	0.056	0.099
Rpim	0.006	0.010
Number of reflections	55974	4021
<I/σ(I)>	102.1	57.1
Completeness [%]	99.9	99.4
Redundancy	100.5	95.9
CC(1/2)	1.000	0.999

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.2 M potassium bromide, 0.2 M potassium thiocyanate, 0.1 sodium acetate, 3% v/v PGA, 28% v/v PEG 550 MME