5E0O

Brugia malayi Trehalose-6 Phosphate Phosphatase in complex with PEG at the active site.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE BM14
Synchrotron site	ESRF
Beamline	BM14
Temperature [K]	100
Detector technology	CCD
Collection date	2013-12-08
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.987
Spacegroup name	P 64 2 2
Unit cell lengths	167.931, 167.931, 102.956
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	43.859 - 3.000
R-factor	0.2202
Rwork	0.218
R-free	0.25740
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ofz
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.9-1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.859	3.200
High resolution limit [Å]	3.000	3.000
Rmerge	0.144	0.800
Number of reflections	18275
<I/σ(I)>	16.25	2
Completeness [%]	99.5	98.6
Redundancy	25.6	20.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	295	Large good diffractable crystal grow with in 7-8 days.