5QUF

HumRadA1.2 soaked with napht-2,3-diol overnight at 20 mM

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	CCD
Collection date	2009-02-16
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9794
Spacegroup name	P 21 21 2
Unit cell lengths	69.071, 72.919, 40.401
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.401 - 1.350
R-factor	0.1701
Rwork	0.169
R-free	0.19570
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]	40.401	40.401	1.430
High resolution limit [Å]	1.350	4.030	1.350
Rmerge	0.089	0.050	1.147
Rmeas	0.096	0.055	1.267
Total number of observations	296891
Number of reflections	42489	1854	4901
<I/σ(I)>	12.08	32.68	1.35
Completeness [%]	93.0	99.3	67.1
Redundancy	6.987	6.643	5.369
CC(1/2)	0.998	0.997	0.505

Crystallization Conditions

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