7M7T

Human DNA Pol eta S113A with dT-ended primer and dATP: in crystallo reaction for 0 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	2013-03-07
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1
Spacegroup name	P 61
Unit cell lengths	98.629, 98.629, 82.020
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	26.900 - 1.460
R-factor	0.1814
Rwork	0.179
R-free	0.20810
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	4ecq
RMSD bond length	0.007
RMSD bond angle	1.028
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	1.530
High resolution limit [Å]	1.460	4.070	1.500
Rmerge	0.062	0.024	0.606
Number of reflections	77575	3653	3554
<I/σ(I)>	13.2
Completeness [%]	99.1	98.6	98.2
Redundancy	3.3	3.3	3.1

Crystallization Conditions

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