7UAV

Structure of Clostridium botulinum prophage Tad1 in apo state

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	80
Detector technology	PIXEL
Collection date	2022-02-12
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.97918
Spacegroup name	H 3 2
Unit cell lengths	155.954, 155.954, 161.448
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	48.670 - 2.200
R-factor	0.2033
Rwork	0.201
R-free	0.24780
Structure solution method	SAD
RMSD bond length	0.002
RMSD bond angle	0.400
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	AutoSol
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.670	2.270
High resolution limit [Å]	2.200	2.200
Rpim	0.033	0.793
Number of reflections	38341	3296
<I/σ(I)>	15.2
Completeness [%]	100.0
Redundancy	41.5
CC(1/2)	0.999	0.705

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	0.1 M Tris-HCl pH 7.5 and 40% PEG 200