5KFO

Human DNA polymerase eta-DNA ternary complex with Sp-dATP-alpha-S: reaction with 1 mM Mn2+ for 1800s

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2014-07-03
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.0
Spacegroup name	P 61
Unit cell lengths	98.790, 98.790, 82.030
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	19.943 - 1.520
R-factor	0.1815
Rwork	0.179
R-free	0.21210
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ecq
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	MOLREP
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	20.000		1.560
High resolution limit [Å]	1.520	6.800	1.520
Rmerge	0.055	0.021	0.686
Number of reflections	69813
<I/σ(I)>	23.6	84.22	2.49
Completeness [%]	99.9	95.9	100
Redundancy	7.4
CC(1/2)	1.000

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	6	298	17% PEG 2000MME, 0.1 M MES