9FEQ

LSSmOrange (P1) - Directionality of Optical Properties of Fluorescent Proteins

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-01-19
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9184
Spacegroup name	P 21 21 21
Unit cell lengths	50.950, 62.080, 68.820
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.100 - 1.600
R-factor	0.17931
Rwork	0.177
R-free	0.21447
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.013
RMSD bond angle	1.963
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.960
High resolution limit [Å]	1.600	5.510	1.850
Rmerge	0.146	0.036	2.849
Rmeas	0.161	0.040	3.156
Number of reflections	36428	1373	5872
<I/σ(I)>	8.41
Completeness [%]	99.7
Redundancy	3.8
CC(1/2)	0.998	0.999	0.337

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	291	40 % v/v Polyethylene glycol 300 100 mM MES 200 mM Calcium acetate