9C6Z

Crystal structure of Staphylococcal Superantigen-Like protein 11 in complex with FB127

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 19-ID
Synchrotron site	NSLS-II
Beamline	19-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-09-08
Detector	DECTRIS EIGER2 XE 9M
Wavelength(s)	0.979
Spacegroup name	P 31 2 1
Unit cell lengths	101.370, 101.370, 65.230
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	52.413 - 2.137
Rwork	0.201
R-free	0.23630
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.831
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.400	2.193
High resolution limit [Å]	2.137	2.140
Rmerge	0.186
Number of reflections	21715	2127
<I/σ(I)>	9.44
Completeness [%]	99.8	99.75
Redundancy	9.8
CC(1/2)	0.993	0.926

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	50 mM Tris-HCl pH 8.5, 50 mM lithium sulphate, 50 mM sodium sulphate, 30% PEG 400