8JLS

Crystal structure of the Green fluorescent protein SET203EF223DA227 variant at pH 6.0

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	193
Detector technology	CCD
Collection date	2022-06-14
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1.0000
Spacegroup name	P 21 21 21
Unit cell lengths	35.190, 46.438, 121.856
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.390 - 1.450
R-factor	0.1818
Rwork	0.180
R-free	0.20310
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	1.040
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.19.2_4158: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.500
High resolution limit [Å]	1.450	3.120	1.450
Rmerge	0.125	0.099	0.394
Rmeas	0.130	0.103	0.421
Rpim	0.036	0.028	0.143
Total number of observations	404720
Number of reflections	35914	3895	3271
<I/σ(I)>	5.6
Completeness [%]	98.7	99.8	91.9
Redundancy	11.3	12.7	7.4
CC(1/2)	0.988	0.995	0.802

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	0.1M acetate pH 6.0, 25% (w/v) PEG 1500, 30% (w/v) MPD