5XLI

Structure of anti-Angiotensin II type2 receptor antibody (D5711-4A03)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-1A
Synchrotron site	Photon Factory
Beamline	BL-1A
Temperature [K]	100
Detector technology	CCD
Collection date	2016-02-22
Detector	DECTRIS EIGER X 4M
Wavelength(s)	1.1
Spacegroup name	P 1 21 1
Unit cell lengths	41.654, 150.498, 75.322
Unit cell angles	90.00, 93.10, 90.00

Refinement procedure

Resolution	19.771 - 1.696
R-factor	0.1814
Rwork	0.179
R-free	0.21590
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1mre 1baf
RMSD bond length	0.007
RMSD bond angle	0.883
Data scaling software	XSCALE
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	19.771	19.771	1.800
High resolution limit [Å]	1.700	5.060	1.700
Rmerge	0.131	0.085	1.203
Rmeas	0.142	0.092	1.301
Total number of observations	687903
Number of reflections	101148	3924	15619
<I/σ(I)>	9.02	22.84	1.49
Completeness [%]	99.1	99.7	94.8
Redundancy	6.801	6.554	6.865
CC(1/2)	0.995	0.992	0.633

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	50mM KH2PO4, 20% PEG 8000, 10% Glycerol