7E5T

Crystal structure of Fsa2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-02-09
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.979400
Spacegroup name	P 1 21 1
Unit cell lengths	133.929, 80.229, 135.159
Unit cell angles	90.00, 108.53, 90.00

Refinement procedure

Resolution	45.044 - 2.170
R-factor	0.182641334888
Rwork	0.180
R-free	0.23522
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	Phm7
RMSD bond length	0.004
RMSD bond angle	0.700
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER (2.7.17)
Refinement software	PHENIX (1.11.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.044	2.248
High resolution limit [Å]	2.170	2.170
Rmerge	0.109
Number of reflections	141327	13856
<I/σ(I)>	8.48
Completeness [%]	97.6
Redundancy	3.5
CC(1/2)	0.998	0.780

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	26-29% (v/v) polyethylene glycol 3350, 0.10M Bis-Tris HCl