7M7P

Human DNA Pol eta S113A with dA-ended primer and dAMPNPP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-BM
Synchrotron site	APS
Beamline	22-BM
Temperature [K]	100
Detector technology	CCD
Collection date	2013-07-11
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1
Spacegroup name	P 61
Unit cell lengths	98.771, 98.771, 81.841
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	31.510 - 1.800
R-factor	0.2031
Rwork	0.200
R-free	0.24270
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	4ecq
RMSD bond length	0.008
RMSD bond angle	1.218
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	35.000	35.000	1.830
High resolution limit [Å]	1.800	4.880	1.800
Rmerge	0.125	0.028	0.661
Total number of observations	158176
Number of reflections	41928	2120	2087
<I/σ(I)>	9
Completeness [%]	99.7	97.8	100
Redundancy	3.8	3.8	3.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	6	295	15% PEG 2000 MME, 100 mM MES