8FOG

Crystal structure of human DNA polymerase eta incorporating dITP across dT

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-2
Synchrotron site	NSLS-II
Beamline	17-ID-2
Temperature [K]	120
Detector technology	PIXEL
Collection date	2022-06-06
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97933
Spacegroup name	P 61
Unit cell lengths	99.329, 99.329, 80.617
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	49.660 - 2.290
R-factor	0.2284
Rwork	0.226
R-free	0.28960
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4o3n
RMSD bond length	0.009
RMSD bond angle	1.064
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	58.820	2.330
High resolution limit [Å]	2.290	2.290
Number of reflections	20504	1014
<I/σ(I)>	5.8
Completeness [%]	100.0
Redundancy	10.2
CC(1/2)	0.996	0.448

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	100 mM MES, pH 6.5, 5 mM magnesium chloride, 18% PEG2000 MME