5LPT

tRNA guanine Transglycosylase (TGT) in co-crystallized complex (space group P21) with 6-amino-2-(methylamino)-4-(2-((2R,3R,4S,5R,6S)-3,4,5,6-tetramethoxytetrahydro-2H-pyran-2-yl)ethyl)-1H-imidazo[4,5-g]quinazolin-8(7H)-one

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-10-24
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.918409
Spacegroup name	P 1 21 1
Unit cell lengths	68.745, 78.866, 84.891
Unit cell angles	90.00, 108.72, 90.00

Refinement procedure

Resolution	40.510 - 2.360
R-factor	0.2026
Rwork	0.201
R-free	0.23340
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1p0d
RMSD bond length	0.006
RMSD bond angle	0.702
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: 1492))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.290	2.500
High resolution limit [Å]	2.360	2.360
Rmerge		0.495
Number of reflections	35384
<I/σ(I)>	8.1	2.6
Completeness [%]	99.0	96.6
Redundancy	3.4	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	288	13% PEG 8000, 100mM MES, 1mM DTT, 10% DMSO