4ZPB

Coxsackievirus B3 Polymerase - F364W mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 4.2.2
Synchrotron site	ALS
Beamline	4.2.2
Temperature [K]	100
Detector technology	CCD
Collection date	2014-07-31
Detector	ADSC QUANTUM 210
Wavelength(s)	1.00
Spacegroup name	P 43 21 2
Unit cell lengths	74.610, 74.610, 289.427
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	52.757 - 1.797
R-factor	0.1888
Rwork	0.188
R-free	0.22660
RMSD bond length	0.008
RMSD bond angle	0.834
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.10_2155: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	52.757		1.910
High resolution limit [Å]	1.797	5.370	1.800
Rmerge	0.091	0.048	0.664
Rmeas	0.098	0.051	0.721
Total number of observations	1052868
Number of reflections	144867	5421	23061
<I/σ(I)>	14.79	36.66	2.35
Completeness [%]	99.7	99.9	98
Redundancy	13.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	289	0.085 M Tris pH 7.5, 1.2 M Ammonium Sulfate , 25% Glycerol