6JXF

Photoswitchable fluorescent protein Gamillus, off-state (pH7.0)

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	2016-11-18
Detector	RAYONIX MX300HE
Wavelength(s)	0.900
Spacegroup name	I 21 3
Unit cell lengths	161.711, 161.711, 161.711
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.680 - 1.800
R-factor	0.1543
Rwork	0.154
R-free	0.16770
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5y00
RMSD bond length	0.034
RMSD bond angle	2.939
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.682	46.682	1.910
High resolution limit [Å]	1.800	5.360	1.800
Rmerge	0.064	0.035	0.438
Rmeas	0.069	0.038	0.470
Total number of observations	480868
Number of reflections	64910	2452	10396
<I/σ(I)>	17.34	35.06	3.91
Completeness [%]	99.7	95.1	99.5
Redundancy	7.408	6.714	7.55
CC(1/2)	0.999	0.999	0.939

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	298	Ammonium phosphate, sodium citrate, sodium chloride, HEPES, pH5.5