6BAR

Crystal structure of Thermus thermophilus Rod shape determining protein RodA (Q5SIX3_THET8)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	70
Detector technology	PIXEL
Collection date	2017-07-05
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.033
Spacegroup name	C 1 2 1
Unit cell lengths	122.405, 80.012, 47.827
Unit cell angles	90.00, 91.06, 90.00

Refinement procedure

Resolution	40.006 - 2.908
R-factor	0.2335
Rwork	0.229
R-free	0.27360
RMSD bond length	0.005
RMSD bond angle	0.825
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((dev_2880: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.006	3.100
High resolution limit [Å]	2.908	2.908
Number of reflections	18684	1605
<I/σ(I)>	6.69	0.69
Completeness [%]	98.4	98.8
Redundancy	3.02	3.15
CC(1/2)	0.997	0.458

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE	8.2	293	41.5% PEG 200, 100 mM NaCL, 100 mM MgCl2*6H2O, 100 mM Tris pH 8.2