6NBM

CRYSTAL STRUCTURE OF ENOLASE FROM LEGIONELLA PNEUMOPHILA BOUND TO PHOSPHATE AND MAGNESIUM

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2018-04-05
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.97872
Spacegroup name	P 42 21 2
Unit cell lengths	116.770, 116.770, 142.770
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.190 - 1.900
R-factor	0.163
Rwork	0.161
R-free	0.19500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6nb2
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (DEV_3318)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.950
High resolution limit [Å]	1.900	1.900
Rmerge	0.051	0.529
Number of reflections	77934	31590
<I/σ(I)>	20.1	3.07
Completeness [%]	99.8	99.9
Redundancy	13.62

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	289	MORPHEUS H3 (50 MM IMIDAZOLE, 50 MM MES PH 6.5, 20 MM L-GLUTAMIC ACID, 20 MM ALANINE, 20 MM GLYCINE, 20 MM LYSINE;, 20 MM SERINE, 20% GLYCEROL, 10% PEG 4000, TRAY 297444H3 PUCK RLK3-10