9GL5

X-ray structure of the Thermus thermophilus Q190E mutant of the PilF-GSPIIB domain in the c-di-GMP bound state

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P13 (MX1)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-08-05
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.976
Spacegroup name	H 3
Unit cell lengths	107.966, 107.966, 86.366
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	32.710 - 1.900
R-factor	0.1944
Rwork	0.193
R-free	0.22510
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	1.064
Data reduction software	XDS
Data scaling software	autoPROC
Phasing software	PHENIX
Refinement software	PHENIX (v1.17.1-3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	32.710	1.968
High resolution limit [Å]	1.900	1.900
Rmerge	0.105
Rmeas	0.111
Rpim	0.034
Number of reflections	29580	2977
<I/σ(I)>	10.12
Completeness [%]	100.0
Redundancy	10.4
CC(1/2)	0.997	0.636

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	291	1.6M LiSO4 0.1 M Sodiumacetate pH 7.0