9F1X

SSX room temperature structure of Oscillatoria acuminata adenylyate cyclase.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P14 (MX2)
Temperature [K]	293
Detector technology	PIXEL
Collection date	2022-10-29
Detector	DECTRIS EIGER X 4M
Wavelength(s)	0.978
Spacegroup name	P 21 21 2
Unit cell lengths	101.510, 53.930, 72.050
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	58.750 - 1.800
R-factor	0.1856
Rwork	0.184
R-free	0.21220
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.970
Data reduction software	CrystFEL
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.19.2_4158: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	59.000	1.860
High resolution limit [Å]	1.800	1.800
Number of reflections	36950	3615
<I/σ(I)>	7.8
Completeness [%]	100.0
Redundancy	595
CC(1/2)	0.999	0.567

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE	8.5	293	0.06 M divalents, 0.1 M Tris-Bicine, 30% v/v PEG550 MME-PEG20000