6SIR

Crystal structure of the guanylate cyclase domain of RhGC from Catenaria anguillulae in complex with GTP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-07-29
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9686
Spacegroup name	P 21 21 21
Unit cell lengths	58.650, 95.170, 138.660
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.950 - 1.700
R-factor	0.1831
Rwork	0.182
R-free	0.20940
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2w01
RMSD bond length	0.006
RMSD bond angle	0.816
Data reduction software	DIALS (1.10)
Data scaling software	Aimless (0.7.1)
Phasing software	PHASER (2.8.2)
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.520	1.730
High resolution limit [Å]	1.700	1.700
Rmerge	0.073	1.270
Rmeas	0.076	1.320
Rpim	0.021	0.360
Number of reflections	85155	4426
<I/σ(I)>	20.3	2.2
Completeness [%]	99.0	98
Redundancy	13.2	13.5
CC(1/2)	1.000	0.788

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M MIB pH 4.4, 22% PEG 2000