5O5K

X-ray structure of a bacterial adenylyl cyclase soluble domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	293
Detector technology	PIXEL
Collection date	2016-10-19
Detector	DECTRIS PILATUS 2M-F
Wavelength(s)	1
Spacegroup name	C 1 2 1
Unit cell lengths	145.420, 85.690, 318.010
Unit cell angles	90.00, 103.77, 90.00

Refinement procedure

Resolution	47.303 - 3.400
R-factor	0.2459
Rwork	0.245
R-free	0.26580
RMSD bond length	0.012
RMSD bond angle	1.569
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall
Low resolution limit [Å]	46.850
High resolution limit [Å]	3.200
Number of reflections	62261
<I/σ(I)>	4.11
Completeness [%]	98.0
Redundancy	5.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M NaCacodylate pH 6.5, 0.2 M LiSO4, 8-10% PEG 1000, 8-10% PEG 8000