9DQU

Product complex of DNA polymerase iota with Pyrophosphate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 4.2.2
Synchrotron site	ALS
Beamline	4.2.2
Temperature [K]	100
Detector technology	CCD
Collection date	2019-03-08
Detector	NOIR-1
Wavelength(s)	1
Spacegroup name	P 65 2 2
Unit cell lengths	97.488, 97.488, 201.550
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	43.270 - 2.200
R-factor	0.2387
Rwork	0.237
R-free	0.27750
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.708
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.880	2.280
High resolution limit [Å]	2.030	2.200
Rpim	0.026	0.505
Number of reflections	29552	2894
<I/σ(I)>	22.9	1.7
Completeness [%]	100.0	100
Redundancy	20.6	20.6
CC(1/2)	1.000	0.788

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.4	291	100 mM HEPES pH 7 1.5 -1.8 M Ammonium Sulfate 5 mM EDTA