5OUW

Metal free structure of SynFtn

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-11-20
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9795
Spacegroup name	F 4 3 2
Unit cell lengths	177.740, 177.740, 177.740
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	53.591 - 2.050
R-factor	0.156
Rwork	0.154
R-free	0.19710
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1eum
RMSD bond length	0.006
RMSD bond angle	0.685
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHENIX
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	53.590	2.100
High resolution limit [Å]	2.050	2.050
Rmerge	0.075	0.644
Rmeas	0.075	0.649
Rpim	0.010	0.085
Number of reflections	15595
<I/σ(I)>	53.2
Completeness [%]	99.7
Redundancy	54.9
CC(1/2)	1.000	0.986

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	ammonium acetate, sodium chloride