9SIN

Phage epsilon15 tailspike gp20 containing domains beta-helix, beta-sandwich and petal domains with three hexasaccharides of the Salmonella Anatum O-antigen

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-02-23
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97926
Spacegroup name	H 3
Unit cell lengths	117.522, 117.522, 250.680
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	48.070 - 2.000
Rwork	0.166
R-free	0.19070
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.890
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0430 (refmacat 0.4.105))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.070	2.040
High resolution limit [Å]	2.000	2.000
Number of reflections	86511	4605
<I/σ(I)>	11.8	1.7
Completeness [%]	99.2	99.7
Redundancy	3.5	3.6
CC(1/2)	0.999	0.620

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.6	294	20 mM Tris-Hcl, 2M Na-formate, 100 mM Na-acetate pH 4.6