7LLQ

Substrate-dependent divergence of leukotriene A4 hydrolase aminopeptidase activity

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	BRUKER AXS MICROSTAR
Temperature [K]	100
Detector technology	CCD
Collection date	2018-12-12
Detector	Bruker Platinum 135
Wavelength(s)	1.54
Spacegroup name	P 32
Unit cell lengths	138.054, 138.054, 84.257
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.190 - 2.850
R-factor	0.201
Rwork	0.200
R-free	0.22900
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ms6
RMSD bond length	0.006
RMSD bond angle	0.752
Data reduction software	PROTEUM
Data scaling software	PROTEUM
Phasing software	PROTEUM
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.190	2.910
High resolution limit [Å]	2.850	2.850
Rmerge	0.200	0.272
Number of reflections	81035	40598
<I/σ(I)>	5.86
Completeness [%]	96.8
Redundancy	8.93

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295.15	60-90 mM magnesium formate dihydrate, 20-25 % PEG3350