6EIP

DYRK1A in complex with XMD8-62e

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-09-19
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.984003
Spacegroup name	P 21 21 21
Unit cell lengths	87.950, 88.370, 229.230
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.300 - 2.560
R-factor	0.24266
Rwork	0.241
R-free	0.26620
RMSD bond length	0.007
RMSD bond angle	1.145
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	REFMAC (5.8.0155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.710
High resolution limit [Å]	2.560	2.560
Rmeas	0.139	0.868
Number of reflections	57776
<I/σ(I)>	10.33	1.87
Completeness [%]	98.4
Redundancy	4.9
CC(1/2)	0.996	0.745

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M KSCN; 0.05M LiCl; 10% PEG 3350, pH 6.8