8ANT

Crystal structure of 6xhis-tagged phi3T_93 protein

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	2021-09-17
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97925
Spacegroup name	P 1 21 1
Unit cell lengths	37.150, 50.828, 55.804
Unit cell angles	90.00, 101.96, 90.00

Refinement procedure

Resolution	37.200 - 1.900
R-factor	0.2181
Rwork	0.216
R-free	0.24890
Structure solution method	AB INITIO PHASING
RMSD bond angle	5.690
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	Arcimboldo
Refinement software	PHENIX (1.20_4459)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.830	1.940
High resolution limit [Å]	1.900	1.900
Rmerge	0.081	0.382
Number of reflections	16124	1017
<I/σ(I)>	8
Completeness [%]	99.7	98.8
Redundancy	6
CC(1/2)	0.995	0.975

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	294.15	0.1M Tris pH8, 5% glycerol, 0.6M Na/K tartrate