7Q8E

Crystal Structure of the MurT-GatD Enzyme Complex from Staphylococcus aureus COL strain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-07-13
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.8731
Spacegroup name	P 21 21 21
Unit cell lengths	107.094, 111.094, 112.424
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.309 - 2.900
R-factor	0.2407687704
Rwork	0.240
R-free	0.26452
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6gs2
RMSD bond length	0.002
RMSD bond angle	0.486
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.12_2829)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.310	3.060
High resolution limit [Å]	2.900	2.900
Rpim	0.113	0.696
Number of reflections	30388	4366
<I/σ(I)>	6.7	17
Completeness [%]	100.0	100
Redundancy	6.9	7.4
CC(1/2)	0.990	0.580

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	30 % (w/v) PEG 4,000, 100 mM Tris-HCl pH 8.5 and 200 mM MgCl2;