6JGI

Crystal structure of the S65T/F99S/M153T/V163A variant of GFP at 0.85 A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL44XU
Synchrotron site	SPring-8
Beamline	BL44XU
Temperature [K]	56
Detector technology	CCD
Collection date	2016-05-18
Detector	RAYONIX MX300HE
Wavelength(s)	0.75
Spacegroup name	P 21 21 21
Unit cell lengths	50.857, 62.403, 69.172
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.334 - 0.850
R-factor	0.0932
Rwork	0.092
R-free	0.11180
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2wur
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	0.810
High resolution limit [Å]	0.800	2.170	0.800
Rmerge	0.090	0.062	1.661
Rmeas	0.099	0.067	1.847
Rpim	0.039	0.026	0.791
Number of reflections	226086	11828	11137
<I/σ(I)>	7.8
Completeness [%]	97.8	97.4	97.5
Redundancy	5.7	6.5	5.2
CC(1/2)		0.994	0.295

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	8.5	308	PEG 4000, MgCl2, Tris-HCl buffer