6JBW

Structure of Tps1/UDP complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-05-22
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9785
Spacegroup name	P 2 21 21
Unit cell lengths	92.751, 99.295, 121.708
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 2.650
R-factor	0.212
Rwork	0.210
R-free	0.25800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1uqu
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.970	2.700
High resolution limit [Å]	2.650	2.650
Rmerge	0.077
Rpim	0.023
Number of reflections	33303	3263
<I/σ(I)>	36.55
Completeness [%]	99.7
Redundancy	6.6
CC(1/2)	1.000	0.959

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	0.2 M ammonium sulfate, 0.1 M Tris-HCl, pH 8.9, 20% PEG 3350 (v/v)