6JGH

Crystal structure of the F99S/M153T/V163A/T203I variant of GFP at 0.94 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	2016-12-13
Detector	RAYONIX MX300HE
Wavelength(s)	0.75
Spacegroup name	P 21 21 21
Unit cell lengths	50.641, 62.506, 68.179
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.928 - 0.940
R-factor	0.108
Rwork	0.107
R-free	0.12900
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2wur
Data reduction software	DENZO
Data scaling software	SDMS
Phasing software	PHASER
Refinement software	SHELXL

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	0.960
High resolution limit [Å]	0.940	2.550	0.940
Rmerge	0.147	0.064	1.260
Rmeas	0.154	0.067	1.358
Rpim	0.047	0.019	0.503
Number of reflections	141942	7529	6969
<I/σ(I)>	5.1
Completeness [%]	99.8	99.9	99.3
Redundancy	8.9	11.9	7.1
CC(1/2)		0.998	0.542

Crystallization Conditions

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