9OAY

TNA polymerase, 8-64, ternary complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.1
Synchrotron site	ALS
Beamline	5.0.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-05-06
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1
Spacegroup name	P 21 21 21
Unit cell lengths	77.713, 101.530, 110.675
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.590 - 2.380
R-factor	0.219
Rwork	0.216
R-free	0.26600
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.522
Data reduction software	XDS
Data scaling software	pointless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.590	2.470
High resolution limit [Å]	2.380	2.380
Rmerge	0.073	0.766
Number of reflections	38977	3519
<I/σ(I)>	19.45
Completeness [%]	99.9
Redundancy	6.6
CC(1/2)	0.999	0.842

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	0.2 M sodium iodide, 20 % polyethylene glycol 3350, and 0.1 M taurine