5LS4

Mopeia virus exonuclease domain complexed with Calcium

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	93.15
Detector technology	CCD
Collection date	2015-09-09
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.873
Spacegroup name	C 1 2 1
Unit cell lengths	131.962, 37.913, 48.986
Unit cell angles	90.00, 104.07, 90.00

Refinement procedure

Resolution	47.516 - 1.469
R-factor	0.1715
Rwork	0.170
R-free	0.19700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5lrp
RMSD bond length	0.010
RMSD bond angle	1.258
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER (2.5.6)
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.520	1.521
High resolution limit [Å]	1.469	1.469
Rmerge	0.073	0.500
Number of reflections	40307
<I/σ(I)>	14.28	2.8
Completeness [%]	99.7	97.66
Redundancy	5.6	5.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293.15	0.1 M MES pH 6.5 and 25 % (M/W) PEG 8000)