5FWQ

Apo structure of human Leukotriene A4 hydrolase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-07-14
Detector	DECTRIS PILATUS 6M
Spacegroup name	P 21 21 21
Unit cell lengths	76.337, 86.980, 96.310
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.291 - 2.047
R-factor	0.1939
Rwork	0.193
R-free	0.22300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5aen
RMSD bond length	0.007
RMSD bond angle	1.008
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER (MR)
Refinement software	PHENIX ((PHENIX.REFINE))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.290	2.120
High resolution limit [Å]	2.050	2.050
Rmerge	0.310	1.160
Number of reflections	40948
<I/σ(I)>	7.58	1.87
Completeness [%]	99.7	98.6
Redundancy	13.3	13.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		290.55	PROTEIN SOLUTION: 10 MM TRIS-HCL, 25 MM KCL, 4-8 MG/ML PROTEIN (PH8); PRECIPITATE SOLUTION: 0,15M IMIDAZOL/HCL PH6.5; 0,1 M NAACETAT, 14% PEG8000, 5 MM YBCL3 AND 25 MM 5-CHLORO-3-HYDROXYPYRIDINE; HANGING DROP VAPOR-DIFFUSION AT 290.55 K