4P94

The crystal structure of the soluble domain of Sulfolobus acidocaldarius FlaF (residues 35-164)

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	2013-07-20
Detector	ADSC QUANTUM 315
Wavelength(s)	1.0332
Spacegroup name	I 2 3
Unit cell lengths	127.257, 127.257, 127.257
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.960 - 1.651
R-factor	0.174
Rwork	0.173
R-free	0.19990
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4LIO
RMSD bond length	0.007
RMSD bond angle	1.062
Data scaling software	SCALA (0.1.27)
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	44.960	44.960	1.550
High resolution limit [Å]	1.520	8.330	1.520
Rmerge	0.065	0.036	0.023
Rpim	0.010	0.005	0.425
Total number of observations	1992238	20047	77732
Number of reflections	52512
<I/σ(I)>	33.6	127.7	2.4
Completeness [%]	100.0	99.4	100
Redundancy	37.9	56.3	30

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	288	35% Tacsimate