7DB3

Crystal structure of Drosophila melanogaster Noppera-bo, glutathione S-transferase epsilon 14 (DmGSTE14), in TDP011-bound form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-5A
Synchrotron site	Photon Factory
Beamline	BL-5A
Temperature [K]	100
Detector technology	CCD
Collection date	2016-06-27
Detector	ADSC QUANTUM 210r
Wavelength(s)	1.00000
Spacegroup name	P 21 21 21
Unit cell lengths	58.110, 75.230, 108.510
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	31.580 - 1.700
R-factor	0.1966
Rwork	0.195
R-free	0.22910
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6kem
RMSD bond length	0.005
RMSD bond angle	1.021
Data reduction software	XDS (Jun 17, 2015)
Data scaling software	Aimless (0.5.15)
Phasing software	MOLREP (11.7.02)
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	31.580	1.647
High resolution limit [Å]	1.590	1.590
Rmerge	0.021
Rmeas	0.030
Number of reflections	64650	6374
<I/σ(I)>	12.9
Completeness [%]	100.0
Redundancy	14.3
CC(1/2)	0.999	0.424

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.4	293	34% (v/v) PPG400 in 80mM Bis-Tris, pH 6.4