6GYZ

Crystal structure of GlmM from Staphylococcus aureus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-10-05
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9795
Spacegroup name	P 21 21 21
Unit cell lengths	88.653, 93.884, 156.308
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	80.482 - 3.000
R-factor	0.2244
Rwork	0.222
R-free	0.27270
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3pdk
RMSD bond length	0.004
RMSD bond angle	0.756
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	93.880	3.180
High resolution limit [Å]	3.000	3.000
Rmerge	0.158	1.868
Number of reflections	26871	4266
<I/σ(I)>	8.4	2
Completeness [%]	100.0	100
Redundancy	12.5	12.5
CC(1/2)	0.998	0.842

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	2.2M Na-Malonate