5BUD

Crystal structure of Candida albicans Rai1 in complex with pU5-Mn2+

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	100
Detector technology	CCD
Collection date	2014-02-25
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0
Spacegroup name	P 21 21 2
Unit cell lengths	97.854, 114.638, 84.458
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.470 - 1.990
R-factor	0.18947
Rwork	0.187
R-free	0.24301
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.010
RMSD bond angle	1.396
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.070
High resolution limit [Å]	1.990	2.000
Rmerge	0.090	0.422
Number of reflections	61906
<I/σ(I)>	19.6	4.2
Completeness [%]	99.0	99
Redundancy	6.9	6.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	CaRai1-pU5-Mn2+ complex crystals were obtained using 1:2 protein:RNA molar ratio and 10mM MnCl2 in 0.1M Bis-Tris (pH 5.5) and 18% (w/v) PEG3350