5M3Y

Crystal structure of human glycosylated angiotensinogen

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-07-06
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.987
Spacegroup name	P 41
Unit cell lengths	71.350, 71.350, 125.310
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.800 - 2.300
R-factor	0.1726
Rwork	0.170
R-free	0.18890
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2wxw
RMSD bond length	0.002
RMSD bond angle	0.483
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.800	2.380
High resolution limit [Å]	2.300	2.300
Rmerge	0.057	0.702
Number of reflections	27827
<I/σ(I)>	16.6
Completeness [%]	99.9
Redundancy	6.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	2.0M Ammonium Sulfate, 0.1M Bicine, pH9.0