6FHB

Death-associated Protein Kinase 1 (DAPK1) catalytic and auto-regulatory domains with S289A and S308E mutations

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-02-13
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.07166
Spacegroup name	P 21 21 21
Unit cell lengths	49.507, 76.653, 108.009
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.005 - 1.750
R-factor	0.1887
Rwork	0.187
R-free	0.22150
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4b4l
RMSD bond length	0.007
RMSD bond angle	0.993
Data reduction software	XDS
Data scaling software	Aimless (7.0.021)
Phasing software	PHASER (Phenix 1.9-1692)
Refinement software	PHENIX (1.9-1962)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.350
High resolution limit [Å]	1.301	1.300
Rmerge	0.043
Rmeas	0.053
Rpim	0.030
Number of reflections	141555
<I/σ(I)>	9.3
Completeness [%]	71.2	7.1
Redundancy	2.6	1.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		292.15	10% PEG 8000, 0.2M magnesium acetate