5KC0

Crystal structure of TmRibU, hexagonal crystal form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	100
Detector technology	CCD
Collection date	2012-10-26
Detector	ADSC QUANTUM 4
Wavelength(s)	0.979
Spacegroup name	P 65 2 2
Unit cell lengths	72.611, 72.611, 232.912
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	37.400 - 3.200
R-factor	0.2681
Rwork	0.266
R-free	0.29830
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3p5n
RMSD bond length	0.003
RMSD bond angle	0.639
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]	37.431	3.280
High resolution limit [Å]	3.200	3.200
Rmerge	0.058	0.062
Number of reflections	6009
<I/σ(I)>	31.3
Completeness [%]	91.2
Redundancy	18.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.5	277	100 mM sodium acetate, pH 4.5, 28% PEG400, and 50 mM magnesium acetate