6CL5

Structure of P. aeruginosa R1 pyocin fiber PALES_06171 comprising C-terminal residues 323-701

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-04-30
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.0000
Spacegroup name	P 21 21 21
Unit cell lengths	144.504, 155.031, 200.481
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.690 - 2.324
R-factor	0.1706
Rwork	0.169
R-free	0.20560
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6cl6
RMSD bond length	0.003
RMSD bond angle	0.600
Data reduction software	XDS (December 31, 2011)
Data scaling software	XDS (December 31, 2011)
Phasing software	PHASER (2.3.0)
Refinement software	PHENIX ((dev_3042: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.460
High resolution limit [Å]	2.324	2.324
Rmeas	0.105	0.614
Number of reflections	371962	58288
<I/σ(I)>	8.8	2.08
Completeness [%]	99.2	96.2
Redundancy	3.45	3.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	291	500 mM sodium malonate, 100 mM HEPES, pH 6.0