5NBY

Structure of a bacterial light-regulated adenylyl cylcase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-11-20
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0
Spacegroup name	C 1 2 1
Unit cell lengths	68.430, 143.300, 57.280
Unit cell angles	90.00, 135.48, 90.00

Refinement procedure

Resolution	45.501 - 2.500
R-factor	0.1945
Rwork	0.191
R-free	0.25640
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5m27
RMSD bond length	0.008
RMSD bond angle	0.954
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (dev_2645)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	45.501	45.501	2.600
High resolution limit [Å]	2.500	10.000	2.500
Rmerge	0.151	0.111	1.019
Rmeas	0.159	0.118	1.072
Total number of observations	135017
Number of reflections	13360	215	1469
<I/σ(I)>	13.65	41.61	2.49
Completeness [%]	98.5	93.9	99
Redundancy	10.106	9.456	10.325
CC(1/2)	0.994	0.987	0.807

Crystallization Conditions

crystal ID	method	pH	temperature	details
2