4OZK

Crystal structure of Laterosporulin, a broad spectrum leaderless bacteriocin produced by Brevibacillus laterosporus strain GI-9

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2012-12-12
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.5418
Spacegroup name	P 43 3 2
Unit cell lengths	65.000, 65.000, 65.000
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.069 - 2.038
R-factor	0.1976
Rwork	0.196
R-free	0.22740
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.049
Data reduction software	MOSFLM
Data scaling software	SCALA (3.3.20)
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.7.3_928))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	65.000	45.962	2.140
High resolution limit [Å]	2.038	6.430	2.030
Rmerge		0.037	0.436
Rmeas	0.122
Rpim	0.037	0.015	0.146
Total number of observations	34934	1176	4499
Number of reflections	3319
<I/σ(I)>	17	35	5.3
Completeness [%]	98.9	98.7	92.8
Redundancy	10.5	8.5	10.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.1 M TRIS pH 8.5, 3M NaCl