7M88

Human DNA Pol eta S113A with dA-ended primer and dATP: in crystallo reaction for 300 s

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	2012-10-22
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1
Spacegroup name	P 61
Unit cell lengths	98.323, 98.323, 81.937
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	29.960 - 1.660
R-factor	0.1759
Rwork	0.173
R-free	0.20920
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	4ecq
RMSD bond length	0.007
RMSD bond angle	1.059
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]	30.000	30.000	1.690
High resolution limit [Å]	1.660	4.500	1.660
Rmerge	0.068	0.023	0.659
Total number of observations	186896
Number of reflections	52548	2611	2601
<I/σ(I)>	10.8
Completeness [%]	99.3	95.7	100
Redundancy	3.6	3.6	3.4

Crystallization Conditions

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