5UXF

Crystal Structure of mouse RECON (AKR1C13) in complex with Cyclic di-AMP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	100
Detector technology	CCD
Collection date	2013-11-21
Detector	ADSC QUANTUM 315
Wavelength(s)	1.075
Spacegroup name	P 21 21 21
Unit cell lengths	48.644, 75.422, 88.416
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.182 - 1.501
R-factor	0.1688
Rwork	0.168
R-free	0.18610
RMSD bond length	0.006
RMSD bond angle	0.977
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.10_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	25.000	25.000	1.550
High resolution limit [Å]	1.500	3.230	1.500
Rmerge	0.078	0.058	0.242
Rmeas	0.085	0.064	0.291
Rpim	0.034	0.026	0.159
Total number of observations	295963
Number of reflections	52009
<I/σ(I)>	18.1
Completeness [%]	98.9	97.2	92.7
Redundancy	5.7	5.7	3
CC(1/2)		0.995	0.925

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	293	0.2 M NaCl, 0.1 M Bis-Tris, pH5.5, 25% PEG 3350