6FXO

Crystal structure of Major Bifunctional Autolysin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-10-05
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.918400
Spacegroup name	P 64 2 2
Unit cell lengths	110.168, 110.168, 92.390
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	35.400 - 2.500
R-factor	0.2948
Rwork	0.295
R-free	0.33000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	SagB
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	MAIN

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.390	2.410
High resolution limit [Å]	2.280	2.280
Rmeas	0.091	1.626
Number of reflections	15697	2453
<I/σ(I)>	25.31	1.96
Completeness [%]	99.8	99.3
Redundancy	21.1
CC(1/2)	1.000	0.631

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	2 M Ammonium sulphate