6IGJ

Crystal structure of FT condition 4

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL44XU
Synchrotron site	SPring-8
Beamline	BL44XU
Temperature [K]	100
Detector technology	CCD
Collection date	2014-11-19
Detector	RAYONIX MX300HE
Wavelength(s)	0.9
Spacegroup name	P 31 2 1
Unit cell lengths	53.503, 53.503, 103.975
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	42.323 - 1.501
R-factor	0.1983
Rwork	0.197
R-free	0.22490
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1wkp
RMSD bond length	0.009
RMSD bond angle	0.990
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.530
High resolution limit [Å]	1.500	1.500
Number of reflections	28282	1734
<I/σ(I)>	14.2
Completeness [%]	99.9
Redundancy	10.5
CC(1/2)	0.999	0.709

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	NaCl, PEG3350, MgCl2, imidazole-HCl