5TUM

Crystal structure of tetracycline destructase Tet(56)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 4.2.2
Synchrotron site	ALS
Beamline	4.2.2
Temperature [K]	100
Detector technology	CMOS
Collection date	2016-02-21
Detector	RDI CMOS_8M
Wavelength(s)	1.000032
Spacegroup name	P 21 21 2
Unit cell lengths	76.450, 114.010, 94.840
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.845 - 3.299
R-factor	0.245
Rwork	0.240
R-free	0.29550
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.645
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.8.4_1496)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000
High resolution limit [Å]	3.229	3.229
Number of reflections	12805
<I/σ(I)>	10.76
Completeness [%]	98.5
Redundancy	3.6
CC(1/2)	0.996

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.6	291	0.1 M trisodium citrate, pH 5.6, 10% PEG1000, 10% isopropanol