1Q0S

Binary Structure of T4DAM with AdoHcy

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X26C
Synchrotron site	NSLS
Beamline	X26C
Temperature [K]	110
Detector technology	CCD
Detector	ADSC QUANTUM 4
Wavelength(s)	1.1
Spacegroup name	P 21 21 21
Unit cell lengths	58.600, 63.100, 72.700
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	18.000 - 2.300
Rwork	0.222
R-free	0.26600
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	22.900 *
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS (1.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000 *	2.370
High resolution limit [Å]	2.300	2.350
Rmerge	0.056	0.229
Total number of observations	56092 *
Number of reflections	12701
<I/σ(I)>	16.5	3.9
Completeness [%]	97.6	99.6
Redundancy	4.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	16 *	Ammonium sulfate, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 289K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	26 (mg/ml)
2	1	reservoir	PEG8000	20-25 (%(w/v))
3	1	reservoir	HEPES	100 (mM)	pH7.5
4	1	reservoir	ammonium sulfate	10 (mM)