4ZBH

THE CRYSTAL STRUCTURE OF THE SOLUBLE DOMAIN OF SULFOLOBUS ACIDOCALDARIUS FLAF

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 12.3.1
Synchrotron site	ALS
Beamline	12.3.1
Temperature [K]	100
Detector technology	CCD
Collection date	2012-08-08
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9677
Spacegroup name	P 43 21 2
Unit cell lengths	52.407, 52.407, 100.241
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.440 - 1.500
R-factor	0.16
Rwork	0.158
R-free	0.19600
Structure solution method	SIRAS
RMSD bond length	0.005
RMSD bond angle	1.042
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.8.1_1168)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.550
High resolution limit [Å]	1.500	1.500
Number of reflections	22800
<I/σ(I)>	62.6	3.7
Completeness [%]	98.4	97.6
Redundancy	5.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	288	3 M POTASSIUM CHLORIDE AND 50 mM HEPES, PH7.0, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K