5JXS

Mutant GC216/7AA of 3D polymerase from Foot-and-Mouth Disease Virus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-05-29
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97951
Spacegroup name	P 32 2 1
Unit cell lengths	95.778, 95.778, 100.875
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	43.096 - 2.800
R-factor	0.2083
Rwork	0.205
R-free	0.26430
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1wne
RMSD bond length	0.002
RMSD bond angle	0.479
Data reduction software	XDS
Data scaling software	SCALA
Refinement software	PHENIX ((dev_2341: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.890
High resolution limit [Å]	2.800	2.800
Rmerge	0.083	0.765
Number of reflections	13387
<I/σ(I)>	7.2
Completeness [%]	98.8
Redundancy	2.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	293	30 % PEG 4K, 0.2 M Magnesium acetate, 0.1 M MES pH 6.0 and 4 % butyrolactone.