8XC6

Crystal structure of large stokes shift red fluorescent protein tKeima

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 11C
Synchrotron site	PAL/PLS
Beamline	11C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-18
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9794
Spacegroup name	P 2 21 21
Unit cell lengths	69.887, 83.504, 109.784
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.210 - 3.000
R-factor	0.20079
Rwork	0.196
R-free	0.24669
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.451
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.050
High resolution limit [Å]	3.000	3.000
Number of reflections	13250	649
<I/σ(I)>	10.92	2.07
Completeness [%]	98.9	99.7
Redundancy	4.3	4.6
CC(1/2)	0.981	0.750

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE		277.5	Tris,NaCl