6GT8

Sulfolobus solfataricus 2-keto-3-deoxygluconate aldolase Y132V,T157C variant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	CCD
Collection date	2011-03-29
Detector	RIGAKU SATURN 944+
Wavelength(s)	1.5406
Spacegroup name	P 65 2 2
Unit cell lengths	103.080, 103.080, 243.392
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	36.930 - 3.150
R-factor	0.202
Rwork	0.201
R-free	0.23600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1w37
RMSD bond length	0.009
RMSD bond angle	1.258
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	BALBES
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	51.540	3.370
High resolution limit [Å]	3.150	3.150
Rmerge	0.090	0.275
Number of reflections	13200
<I/σ(I)>	22	5.3
Completeness [%]	95.2	82
Redundancy	12.9	6.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	291	0.1M HEPES pH 6.0, 15% PEG 4K, 8% isopropanol