8SY8

Crystal structure of TsaC

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2022-11-01
Detector	RAYONIX MX-300
Wavelength(s)	0.97872
Spacegroup name	P 32 2 1
Unit cell lengths	115.700, 115.700, 66.300
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	43.590 - 2.180
R-factor	0.2095
Rwork	0.208
R-free	0.22850
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.370
Data reduction software	XDS (20220110)
Data scaling software	XDS (20220110)
Phasing software	PHENIX (1.20.1_4487)
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.590	2.320
High resolution limit [Å]	2.180	2.180
Rmeas	0.072	1.500
Number of reflections	26991	2670
<I/σ(I)>	24.18
Completeness [%]	99.9	99.5
Redundancy	16.68
CC(1/2)	1.000	0.720

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	0.2 M KCl, 20% polyethylene glycol 3350, and 10% glycerol