6EP2

Enterococcus faecalis FIC protein in complex with ADP and calcium ion.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-05-11
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.978570
Spacegroup name	P 43 21 2
Unit cell lengths	125.311, 125.311, 362.879
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	56.041 - 2.150
R-factor	0.1884
Rwork	0.187
R-free	0.21780
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5NUW
RMSD bond length	0.005
RMSD bond angle	0.947
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX ((1.11.1_2575: ???))
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	118.450	2.190
High resolution limit [Å]	2.150	2.150
Rmerge	0.210	1.952
Rpim	0.074
Number of reflections	157467	7730
<I/σ(I)>	12.2	2.1
Completeness [%]	100.0	100
Redundancy	16.9	17.7
CC(1/2)	0.998	0.690

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291.15	14.4 % w/v Polyethylene glycol 8,000 20 % v/v Glycerol, 80 mM MES; pH 6.5, 160 mM Calcium acetate, 5mM MgCl2, 5mM ATPgS