6IS5

P domain of GII.3-TV24 with A-tetrasaccharide complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-5A
Synchrotron site	Photon Factory
Beamline	BL-5A
Temperature [K]	100
Detector technology	CCD
Collection date	2014-05-26
Detector	ADSC QUANTUM 315
Wavelength(s)	1.0
Spacegroup name	P 42 21 2
Unit cell lengths	122.368, 122.368, 215.198
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.250 - 2.501
R-factor	0.1888
Rwork	0.187
R-free	0.22950
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6ir5
RMSD bond length	0.004
RMSD bond angle	0.651
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.590
High resolution limit [Å]	2.500	2.500
Rmerge	0.165	0.518
Number of reflections	57182	5551
<I/σ(I)>	13	4.5
Completeness [%]	100.0	100
Redundancy	8.1	8.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	9.6% (w/v) polyethylene glycol 3350, 160mM ammonium citrate tribasic (pH 7.0), 20mM tri-sodium citrate dehydrate (pH 5.6), 500mM 1,6-hexanediol, 30mM glycl-glycl-glycin