6I3F

Crystal structure of the complex of human angiotensinogen and renin at 2.55 Angstrom

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	2013-03-01
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.987
Spacegroup name	P 63 2 2
Unit cell lengths	124.119, 124.119, 260.911
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	62.010 - 2.550
R-factor	0.20761
Rwork	0.206
R-free	0.23392
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2WXW and 2BKS
RMSD bond length	0.002
RMSD bond angle	1.192
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	62.060	2.650
High resolution limit [Å]	2.550	2.550
Rmerge	0.209	1.250
Rmeas	0.225	1.350
Number of reflections	39602	4393
<I/σ(I)>	10.2	2.1
Completeness [%]	100.0	100
Redundancy	12.7	12.9
CC(1/2)	0.998	0.674

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.6	293	1.76M Ammonium sulfate 0.1M Tris, pH7.6