5SZT

Crystal structure of the large fragment of DNA Polymerase I from Thermus aquaticus in a closed ternary complex with 7-(N-(10-hydroxydecanoyl)-aminopentenyl)-7-deaza-2'-dATP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-05-08
Detector	PSI PILATUS 6M
Wavelength(s)	1.000000
Spacegroup name	P 31 2 1
Unit cell lengths	108.425, 108.425, 90.615
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.949 - 1.800
R-factor	0.1954
Rwork	0.194
R-free	0.22950
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	3m8s
RMSD bond length	0.003
RMSD bond angle	0.634
Data reduction software	XDS
Refinement software	PHENIX ((dev_2443))

Data quality characteristics

	Overall
Low resolution limit [Å]	46.950
High resolution limit [Å]	1.800
Number of reflections	57320
<I/σ(I)>	12.1
Completeness [%]	100.0
Redundancy	9.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	0.05 M sodium cacodylate pH 6.5, 0.01 M magnesium acetate, 0.2 M ammonium acetate, 30% PEG 4000