7EJV

The co-crystal structure of DYRK2 with YK-2-69

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	277
Detector technology	PIXEL
Collection date	2020-07-05
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9785
Spacegroup name	C 2 2 21
Unit cell lengths	60.860, 129.387, 291.733
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.860 - 2.500
R-factor	0.2021
Rwork	0.201
R-free	0.24600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5lxd
RMSD bond length	0.010
RMSD bond angle	1.302
Data reduction software	HKL-2000
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.860	2.589
High resolution limit [Å]	2.500	2.500
Number of reflections	40357	3967
<I/σ(I)>	14.02
Completeness [%]	99.7	99.97
Redundancy	13.3
CC(1/2)	0.998	0.696

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	277	0.1 M sodium citrate pH 5.5, 8% PEG3350