5UEJ

1.30 A crystal structure of DapE enzyme from Neisseria meningitidis MC58

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-09-30
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9795
Spacegroup name	P 21 21 21
Unit cell lengths	74.767, 88.644, 133.402
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.000 - 1.300
R-factor	0.11497
Rwork	0.113
R-free	0.15254
RMSD bond length	0.029
RMSD bond angle	2.435
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	1.320
High resolution limit [Å]	1.300	1.300
Rmerge	0.080
Number of reflections	217263
<I/σ(I)>	22
Completeness [%]	99.4
Redundancy	7.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	293	0.2 M Lithium Sulfate, 0.1 M Tris:HCl pH 8.5, 1.26 M Ammonium Sulfate, 0.05 M DMSO