6PAW

Crystal structure of DAPK2 S308A Calcium/Calmodulin complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P14 (MX2)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-06-06
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9763
Spacegroup name	P 21 21 21
Unit cell lengths	89.440, 95.880, 263.300
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	131.650 - 2.953
R-factor	0.2506
Rwork	0.249
R-free	0.28840
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB entries 2A2A & 1ZUZ
Data reduction software	XDS (November 3, 2014)
Data scaling software	XSCALE (November 3, 2014 BUILT=20141118)
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	131.650	3.200
High resolution limit [Å]	2.950	2.950
Rmerge	0.275	1.853
Number of reflections	48427	1250
<I/σ(I)>	9.5	1.4
Completeness [%]	64.4
Redundancy	8.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	292.15	0.1 M Bis-Tris-HCl, pH 6.5, 0.6 M sodium chloride, 14.3% PEG3350