5I36

Crystal structure of color device state A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	77.15
Detector technology	CCD
Collection date	2013-08-15
Detector	ADSC QUANTUM 315
Wavelength(s)	1.0
Spacegroup name	P 1
Unit cell lengths	67.530, 69.131, 70.106
Unit cell angles	98.19, 97.34, 99.74

Refinement procedure

Resolution	33.583 - 5.123
R-factor	0.1371
Rwork	0.134
R-free	0.16500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3gbi
RMSD bond length	0.013
RMSD bond angle	1.278
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX ((1.10_2152))
Refinement software	PHENIX ((1.10_2152))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.600	5.330
High resolution limit [Å]	5.100	5.240
Rmerge	0.902
Number of reflections	4725
<I/σ(I)>	9.77
Completeness [%]	96.4
Redundancy	3.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293.15	30 mM sodium cacodylate, 50 mM magnesium acetate, 50 mM ammonium sulfate, 5 mM magnesium chloride and 25 mM Tris-HCl (pH 8.5)