6DFT

Trypanosoma brucei deoxyhypusine synthase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-09-20
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97918
Spacegroup name	P 21 21 21
Unit cell lengths	64.358, 242.162, 266.303
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.752 - 3.500
R-factor	0.224
Rwork	0.222
R-free	0.26230
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1rqd
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	3.560
High resolution limit [Å]	3.500	9.480	3.500
Rmerge	0.188	0.081	0.796
Rmeas	0.214	0.092	0.924
Rpim	0.101	0.042	0.455
Total number of observations	214291
Number of reflections	52848	2904	2556
<I/σ(I)>	4.1
Completeness [%]	97.2	97.6	94.4
Redundancy	4.1	4.4	3.4
CC(1/2)		0.984	0.650

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	0.1 M HEPES, 10 mM TCEP, 2 mM NAD+, 8% PEG 6000, 20% ETHYLENE GLYCOL