7A84

rsGreen0.7-K206A-F145H partially in the green-off state

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-06-28
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.9801
Spacegroup name	H 3 2
Unit cell lengths	139.973, 139.973, 73.236
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.693 - 2.100
R-factor	0.2233
Rwork	0.221
R-free	0.26880
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.971
Data reduction software	XDS
Data scaling software	Aimless (0.5.32)
Phasing software	PHASER (2.7.16)
Refinement software	PHENIX (1.11)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.690	46.690	2.160
High resolution limit [Å]	2.100	8.910	2.100
Rmerge	0.046	0.028	0.768
Rmeas	0.047	0.029	0.786
Rpim	0.010	0.007	0.168
Total number of observations	323440	3839	28112
Number of reflections	15971	236	1294
<I/σ(I)>	36.8	97	5
Completeness [%]	99.1	98.6	98.3
Redundancy	20.3	16.3	21.7
CC(1/2)	1.000	1.000	0.976

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	100 mM MES pH 6.0 14 % PEG 400 300 mM NGSB-195