8X8F

Crystal structure of lipoxygenase from Enhygromyxa salina

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 11C
Synchrotron site	PAL/PLS
Beamline	11C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-07-06
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97942
Spacegroup name	P 1 21 1
Unit cell lengths	164.726, 248.590, 164.089
Unit cell angles	90.00, 119.86, 90.00

Refinement procedure

Resolution	49.611 - 2.796
R-factor	0.2279
Rwork	0.227
R-free	0.25380
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4g32
RMSD bond length	0.003
RMSD bond angle	0.587
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.12_2829)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.850
High resolution limit [Å]	2.796	7.590	2.800
Rmerge	0.140	0.076	0.397
Rmeas	0.157	0.083	0.482
Rpim	0.069	0.031	0.267
Number of reflections	258691	13919	10927
<I/σ(I)>	4.3
Completeness [%]	92.4	97.9	78.1
Redundancy	4.3	6.6	2.5
CC(1/2)		0.995	0.320

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	291	0.4M Magnesium chloride, 20mM Cadmium chloride, 0.1M Tris-HCl pH 8.5, 13.5% (w/v) PEG 2000, 15% (v/v) Glycerol