5T5V

LIPOXYGENASE-1 (SOYBEAN) AT 293K

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.3.1
Synchrotron site	ALS
Beamline	8.3.1
Temperature [K]	300
Detector technology	CCD
Collection date	2012-12-15
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.8266
Spacegroup name	P 1 21 1
Unit cell lengths	91.572, 92.754, 100.919
Unit cell angles	90.00, 93.76, 90.00

Refinement procedure

Resolution	91.380 - 1.800
R-factor	0.135
Rwork	0.134
R-free	0.17100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3pzw
RMSD bond length	0.011
RMSD bond angle	1.030
Data reduction software	MOSFLM
Data scaling software	SCALA (3.3.20)
Phasing software	PHASER
Refinement software	PHENIX (1.10PRE_2104)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	92.754	92.754	1.900
High resolution limit [Å]	1.800	5.690	1.800
Rmerge		0.027	0.886
Number of reflections	154694
<I/σ(I)>	8	18.5	0.8
Completeness [%]		100	98.8
Redundancy	4.6	4.7	4.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	300	PEG-3350, Sodium Acetate