6ENO

Double cubane cluster oxidoreductase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-06-27
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9184
Spacegroup name	P 65 2 2
Unit cell lengths	80.591, 80.591, 217.428
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	34.456 - 1.635
R-factor	0.1738
Rwork	0.172
R-free	0.21330
Structure solution method	SAD
RMSD bond length	0.012
RMSD bond angle	1.202
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((dev_2621: ???))

Data quality characteristics

	Overall
Low resolution limit [Å]	42.900
High resolution limit [Å]	1.630
Number of reflections	51968
<I/σ(I)>	13.9
Completeness [%]	98.8
Redundancy	7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291.15	PEG 8000, Na-citrate, Na-dithinite