7DQG

Crystal structure of Salmonella phage acetyltransferase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 11C
Synchrotron site	PAL/PLS
Beamline	11C
Temperature [K]	100.15
Detector technology	PIXEL
Collection date	2019-10-31
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97941
Spacegroup name	P 61 2 2
Unit cell lengths	68.458, 68.458, 218.964
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	40.220 - 2.210
R-factor	0.2095
Rwork	0.209
R-free	0.22490
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5hgz
RMSD bond length	0.003
RMSD bond angle	0.647
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.240
High resolution limit [Å]	2.200	2.200
Rmerge	0.077	0.324
Rmeas	0.091	0.283
Rpim	0.017	0.067
Number of reflections	15793	718
<I/σ(I)>	36.7
Completeness [%]	98.7
Redundancy	21.1
CC(1/2)	0.994	0.959

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		287.15	0.4 M sodium malonate pH 6.0, 0.1 M MES monohydrate pH 6.0, 0.5% (w/v) PEG 10000