6S9O

Designed Armadillo Repeat protein internal Lock1 fused to target peptide KRKRKLKFKR

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	2017-11-06
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.999998
Spacegroup name	C 1 2 1
Unit cell lengths	168.700, 82.400, 191.780
Unit cell angles	90.00, 90.36, 90.00

Refinement procedure

Resolution	48.453 - 3.170
R-factor	0.2378
Rwork	0.235
R-free	0.29150
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	48.453	48.453	3.250
High resolution limit [Å]	3.170	14.180	3.170
Rmerge	0.307	0.050	1.935
Rmeas	0.332	0.055	2.090
Total number of observations	307274
Number of reflections	44419	534	3301
<I/σ(I)>	5.82	25.05	0.95
Completeness [%]	98.5	96.7	99.1
Redundancy	6.918	6.184	7.034
CC(1/2)	0.993	0.999	0.793

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		277.14	25 % PEG smear low 0.04 M CaCl2, 0.04 M Na-formate 0.1 M Tris pH 8