4GZ0

Mus Musculus Tdp2-DNA Substrate Analog (5'-6-aminohexanol) Complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2012-07-04
Detector	MAR scanner 300 mm plate
Wavelength(s)	0.8266
Spacegroup name	P 21 21 21
Unit cell lengths	117.900, 121.100, 167.300
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.238 - 2.113
R-factor	0.1617
Rwork	0.160
R-free	0.19300
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.900
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.7.3_928)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.180
High resolution limit [Å]	2.100	4.520	2.100
Rmerge	0.079	0.057	0.535
Number of reflections	131004
<I/σ(I)>	13
Completeness [%]	97.9	94.3	99
Redundancy	3	3	2.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	4.5	293	45% ethylene glycol, 100mM sodium acetate, 5% PEG 1000, pH 4.5, VAPOR DIFFUSION, temperature 293K