7M7Y

Human DNA Pol eta with dA-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	2013-08-01
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1
Spacegroup name	P 61
Unit cell lengths	98.753, 98.753, 82.159
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	32.320 - 1.800
R-factor	0.1797
Rwork	0.176
R-free	0.22140
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	4ecq
RMSD bond length	0.009
RMSD bond angle	1.175
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	0.131	0.059	0.724
Total number of observations	125519
Number of reflections	41668	1992	2122
<I/σ(I)>	7.1
Completeness [%]	98.6	91.4	100
Redundancy	3	2.8	3.1

Crystallization Conditions

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