8ZBO

Crystal structure of the biphotochromic fluorescent protein moxSAASoti (F97M variant) in its green on-state

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-11-09
Detector	RIGAKU HyPix-6000HE
Wavelength(s)	1.54184
Spacegroup name	P 21 21 21
Unit cell lengths	53.652, 81.254, 98.813
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	21.830 - 2.000
R-factor	0.18041
Rwork	0.178
R-free	0.23107
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.014
RMSD bond angle	2.260
Data reduction software	CrysalisPro
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	21.830	2.050
High resolution limit [Å]	2.000	2.000
Rmerge	0.082	0.449
Rmeas	0.086	0.470
Rpim	0.026	0.138
Total number of observations	325806	23609
Number of reflections	29554	2110
<I/σ(I)>	27.3	5.4
Completeness [%]	99.0
Redundancy	11	11.2
CC(1/2)	0.999	0.954

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		288	0.2 M Magnesium nitrate hexahydrate, 20% w/v Polyethylene glycol 3,350