5KT4

Teranry complex of human DNA polymerase iota R96G inserting dCMPNPP opposite template G in the presence of Mg2+

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2014-10-19
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.97872
Spacegroup name	P 65 2 2
Unit cell lengths	98.119, 98.119, 202.720
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	49.059 - 2.780
R-factor	0.2187
Rwork	0.217
R-free	0.24950
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.653
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.830
High resolution limit [Å]	2.780	7.540	2.780
Rmerge	0.100	0.030	0.922
Number of reflections	15324
<I/σ(I)>	7
Completeness [%]	100.0	99.9	100
Redundancy	17.7	17.6	17.4
CC(1/2)		0.999	0.954

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	277.15	18% PEG MME 5000, 0.1M MES buffer, 0.3M ammonium sulfate