7JHM

Structure of human beta 1,3-N-acetylglucosaminyltransferase 2 with N-acetyl-lactosamine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	87
Detector technology	PIXEL
Collection date	2017-10-06
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.00
Spacegroup name	I 1 2 1
Unit cell lengths	82.509, 76.992, 134.389
Unit cell angles	90.00, 105.06, 90.00

Refinement procedure

Resolution	46.464 - 2.190
R-factor	0.1904
Rwork	0.189
R-free	0.21890
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7jhi
RMSD bond length	0.004
RMSD bond angle	0.782
Data reduction software	XDS
Data scaling software	Aimless (0.5.29)
Phasing software	PHASER
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.464	46.460	2.260
High resolution limit [Å]	2.190	9.030	2.190
Rmerge	0.110	0.030	0.979
Rmeas	0.120	0.032	1.056
Rpim	0.046	0.013	0.394
Total number of observations		4156	25499
Number of reflections	41932	636	3627
<I/σ(I)>	11.7	32.5	2.3
Completeness [%]	99.9	99	99.9
Redundancy	6.8	6.5	7
CC(1/2)	0.999	0.999	0.812

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	24% PEG1500, 20% glycerol