3TO7

Crystal structure of yeast Esa1 HAT domain bound to coenzyme A with active site lysine acetylated

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X6A
Synchrotron site	NSLS
Beamline	X6A
Temperature [K]	100
Detector technology	CCD
Collection date	2011-02-11
Detector	ADSC QUANTUM 270
Wavelength(s)	1.127
Spacegroup name	I 41 3 2
Unit cell lengths	183.040, 183.040, 183.040
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.507 - 1.900
R-factor	0.1992
Rwork	0.198
R-free	0.22600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1mja
RMSD bond length	0.008
RMSD bond angle	1.093
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.7_650))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.930
High resolution limit [Å]	1.900	1.900
Rmerge	0.088	0.416
Number of reflections	41363
<I/σ(I)>	27.2	6.4
Completeness [%]	100.0	100
Redundancy	10.8	10.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	298	0.1 M sodium cacodylate, 1.6 M ammonium sulfate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K