4Y2C

M300V 3D polymerase mutant of EMCV

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	2013-02-02
Detector	PSI PILATUS 6M
Wavelength(s)	0.979
Spacegroup name	I 41 2 2
Unit cell lengths	122.632, 122.632, 198.459
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.360 - 2.200
R-factor	0.21731
Rwork	0.216
R-free	0.24906
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4nyz
RMSD bond length	0.004
RMSD bond angle	0.870
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	REFMAC
Refinement software	REFMAC (5.8.0069)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.360	2.320
High resolution limit [Å]	2.200	2.200
Rmerge	0.081	0.665
Number of reflections	36208
<I/σ(I)>	9	2
Completeness [%]	94.5	97.4
Redundancy	2.8	2.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	10%PEG6000 2.0M NaCl