7QLI

Cis structure of rsKiiro at 290 K

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-12-03
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.7293
Spacegroup name	P 21 21 21
Unit cell lengths	38.560, 73.467, 78.038
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	53.549 - 1.155
Rwork	0.161
R-free	0.17870
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5oq9
RMSD bond length	0.013
RMSD bond angle	1.811
Data reduction software	autoPROC (1.0.5 (20180515))
Data scaling software	STARANISO (1.10.15)
Phasing software	REFMAC (5.8.0267)
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	53.549	1.261
High resolution limit [Å]	1.155	1.159
Rmerge	0.122
Rmeas	0.127
Number of reflections	59836	2992
<I/σ(I)>	12.1
Completeness [%]	77.0
Redundancy	13.2
CC(1/2)	0.999	0.500

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE		293	0.2 M LITHIUM SULFATE 0.1 M TRIS-CL PH 8.5 23-30% PEG 3350,