7RI0

Aspergillus fumigatus Enolase Bound to Phosphoenolpyruvate and 2-Phosphoglycerate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	100
Detector technology	CCD
Collection date	2018-09-30
Detector	ADSC QUANTUM 210r
Wavelength(s)	0.954
Spacegroup name	P 1 21 1
Unit cell lengths	67.858, 84.154, 84.909
Unit cell angles	90.00, 98.04, 90.00

Refinement procedure

Resolution	42.497 - 2.300
R-factor	0.2103
Rwork	0.208
R-free	0.25500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7rhv
Data reduction software	XDS (20190315)
Data scaling software	Aimless (0.5.25)
Phasing software	PHASER (2.8.2)
Refinement software	PHENIX (1.16-3549)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.900	46.900	2.380
High resolution limit [Å]	2.300	8.910	2.300
Rmerge	0.109	0.063	0.342
Rmeas	0.118	0.069	0.368
Rpim	0.044	0.026	0.136
Total number of observations	302573	5243	29996
Number of reflections	42138	764	4090
<I/σ(I)>	13.3	23.5	4.7
Completeness [%]	99.9	99.2	99.9
Redundancy	7.2	6.9	7.3
CC(1/2)	0.995	0.996	0.965

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	289.15	21% PEG 3350, 0.05 M Bis-Tris