5ZTN

The crystal structure of human DYRK2 in complex with Curcumin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-10-01
Detector	RAYONIX MX-225
Wavelength(s)	0.979
Spacegroup name	P 42
Unit cell lengths	83.659, 83.659, 149.127
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.275 - 2.496
R-factor	0.1997
Rwork	0.197
R-free	0.24440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3k2l
RMSD bond length	0.009
RMSD bond angle	1.246
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.275	2.500
High resolution limit [Å]	2.496	2.496
Rpim	0.052	0.632
Number of reflections	35490
<I/σ(I)>	21.8
Completeness [%]	99.8
Redundancy	7.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	291	0.2 M ammonium citrate tribasic, 12%-20% PEG 3350,pH 7.0