4ZPC

Coxsackievirus B3 Polymerase - A341G 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	74.289, 74.289, 288.147
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	58.763 - 1.590
R-factor	0.2132
Rwork	0.213
R-free	0.22960
RMSD bond length	0.008
RMSD bond angle	0.851
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]	58.763	5.960	2.110
High resolution limit [Å]	1.590	4.220	1.990
Rmerge	0.274	0.252	0.574
Rmeas	0.296	0.270	0.662
Total number of observations	656402
Number of reflections	203130	7687	15450
<I/σ(I)>	4.66	8.12	1.08
Completeness [%]	96.7	100	84.2
Redundancy	11.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	289	0.085 M HEPES pH 7.5, 3.6 M NaCl , 15% Glycerol