6SZQ

Crystal structure of human DDAH-1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-03-27
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.99985
Spacegroup name	P 1 21 1
Unit cell lengths	89.146, 76.153, 116.839
Unit cell angles	90.00, 95.47, 90.00

Refinement procedure

Resolution	46.646 - 2.412
R-factor	0.2246
Rwork	0.223
R-free	0.27020
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3i2e
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.646	46.646	2.470
High resolution limit [Å]	2.410	10.790	2.410
Rmerge	0.118	0.037	1.011
Rmeas	0.130	0.041	1.109
Number of reflections	59837	704	4203
<I/σ(I)>	9.89	22.76	1.8
Completeness [%]	99.1	97.6	95.1
Redundancy	5.913	5.776	5.778
CC(1/2)	0.998	0.999	0.755

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	277.15	0.2M NaAc, 0.1M Tris pH 8,5, 30% PEG4000, cryo: reservoir+20% glycerol