9C65

Crystal structure of Staphylococcal Superantigen-Like protein 11 in complex with SB618

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	CCD
Collection date	2023-10-23
Detector	RIGAKU SATURN 944
Wavelength(s)	1.54
Spacegroup name	P 31 2 1
Unit cell lengths	104.464, 104.464, 62.136
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	13.813 - 2.458
Rwork	0.174
R-free	0.20770
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.016
RMSD bond angle	2.672
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]	13.813	2.520
High resolution limit [Å]	2.458	2.458
Rmeas	0.250
Rpim	0.064
Number of reflections	14193	895
<I/σ(I)>	12.51	1.6
Completeness [%]	97.9	92.21
Redundancy	9.9
CC(1/2)	0.996	0.507

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	100 mM HEPES/NaOH pH 7.0, 55% MPD