9OAT

TNA polymerase, 5-270, binary 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	86.796, 110.455, 124.308
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.590 - 2.560
R-factor	0.2205
Rwork	0.218
R-free	0.26750
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.457
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]	46.950	2.652
High resolution limit [Å]	2.560	2.560
Rmerge	0.093	0.863
Number of reflections	38977	3841
<I/σ(I)>	15.08
Completeness [%]	99.4
Redundancy	6.5
CC(1/2)	0.998	0.773

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	0.1M MES pH 6, 0.1M calcium acetate, 15% PEG 400