5YAZ

Crystal structure of the ANKRD domain of KANK1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-04-01
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.98
Spacegroup name	P 1 21 1
Unit cell lengths	29.102, 70.207, 60.655
Unit cell angles	90.00, 96.91, 90.00

Refinement procedure

Resolution	30.107 - 1.900
R-factor	0.1956
Rwork	0.193
R-free	0.23460
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5yay
RMSD bond length	0.014
RMSD bond angle	1.409
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.930
High resolution limit [Å]	1.900	5.160	1.900
Rmerge	0.077	0.033	1.199
Rmeas	0.090	0.039	1.413
Rpim	0.047	0.020	0.741
Number of reflections	19134	988	949
<I/σ(I)>	10.3
Completeness [%]	99.8	98.3	99.9
Redundancy	3.7	3.7	3.5
CC(1/2)		0.998	0.545

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.5	289	0.1 M calcium acetate, 0.1 M Sodium acetate, 10% w/v polyethylene glycol 4000