6AAR

Crystal structure of DAPK1 in complex with purpurin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NW12A
Synchrotron site	Photon Factory
Beamline	AR-NW12A
Temperature [K]	100
Detector technology	CCD
Collection date	2014-05-18
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1.00
Spacegroup name	P 21 21 21
Unit cell lengths	46.723, 62.892, 88.646
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.506 - 1.950
R-factor	0.182
Rwork	0.180
R-free	0.22030
RMSD bond length	0.007
RMSD bond angle	0.901
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((1.10.1-2155_1069))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.510	2.020
High resolution limit [Å]	1.950	1.950
Number of reflections	19530
<I/σ(I)>	17.9
Completeness [%]	99.2
Redundancy	5.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	1.6 M ammonium sulfate, 0.1 M MES pH 6.5