5QUN

Structure of unliganded HumRadA1.6

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	CCD
Collection date	2009-03-12
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.976300
Spacegroup name	P 21 21 21
Unit cell lengths	40.565, 61.957, 87.293
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	26.338 - 1.240
R-factor	0.2171
Rwork	0.215
R-free	0.24890
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	26.338	26.338	1.310
High resolution limit [Å]	1.240	3.680	1.240
Rmerge	0.083	0.034	1.221
Rmeas	0.090	0.037	1.350
Total number of observations	422647
Number of reflections	62867	2515	9686
<I/σ(I)>	12.01	37.76	1.41
Completeness [%]	99.0	96.1	95.7
Redundancy	6.723	6.43	5.412
CC(1/2)	0.999	0.999	0.788

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	291	50 mM Na/K phospate, 5% PEG1000H