5T14

DNA polymerase kappa extending beyond a bulky major benzo[a]pyrene adduct

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	CCD
Collection date	2015-12-09
Detector	RAYONIX MX-300
Wavelength(s)	0.97949
Spacegroup name	P 21 21 21
Unit cell lengths	65.250, 128.820, 167.460
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.000 - 3.000
R-factor	0.2061
Rwork	0.204
R-free	0.26570
RMSD bond length	0.008
RMSD bond angle	1.314
Data reduction software	iMOSFLM
Data scaling software	SCALA
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall
Low resolution limit [Å]	40.000
High resolution limit [Å]	3.000
Number of reflections	28865
<I/σ(I)>	6.8
Completeness [%]	99.5
Redundancy	4.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295.15	PEG400, ammonium nitrate