6AIL

CRYSTAL STRUCTURE AT 1.3 ANGSTROMS RESOLUTION OF A NOVEL UDG, UdgX, FROM Mycobacterium smegmatis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	190
Detector technology	CCD
Collection date	2015-09-24
Detector	ADSC QUANTUM 270
Wavelength(s)	0.987
Spacegroup name	P 1 21 1
Unit cell lengths	36.326, 51.638, 54.362
Unit cell angles	90.00, 105.31, 90.00

Refinement procedure

Resolution	28.106 - 1.335
R-factor	0.1336
Rwork	0.133
R-free	0.15570
Structure solution method	MIR
RMSD bond length	0.009
RMSD bond angle	0.932
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.360
High resolution limit [Å]	1.335	1.340
Rmerge	0.077	0.187
Number of reflections	42217	1864
<I/σ(I)>	55.74
Completeness [%]	96.2
Redundancy	7.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	2.0M Ammonium citrate tribasic pH7.0, 0.1M BIS-TRIS propane pH7.0