3ODT

Crystal structure of WD40 beta propeller domain of Doa1

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 4.2.2
Synchrotron site	ALS
Beamline	4.2.2
Temperature [K]	100
Detector technology	CCD
Collection date	2008-02-01
Detector	NOIR-1
Wavelength(s)	0.97864,0.97880, 0.96411
Spacegroup name	P 1 21 1
Unit cell lengths	33.656, 87.996, 92.265
Unit cell angles	90.00, 96.73, 90.00

Refinement procedure

Resolution	28.854 - 1.350
R-factor	0.1385
Rwork	0.136
R-free	0.17600
Structure solution method	MAD
RMSD bond length	0.012
RMSD bond angle	1.390
Data reduction software	d*TREK
Data scaling software	d*TREK
Phasing software	SOLVE
Refinement software	PHENIX ((phenix.refine: 1.6.4_486))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.330	1.400
High resolution limit [Å]	1.350	1.350
Rmerge	0.045	0.254
Number of reflections	107515
<I/σ(I)>	13.1	3.3
Completeness [%]	92.0	67.9
Redundancy	3.24	2.64

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	291	0.1 M MES, 0.1 M CaCl2, 15% PEG 4000, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K