5TUI

Crystal structure of tetracycline destructase Tet(50) in complex with chlortetracycline

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	2015-10-22
Detector	RDI CMOS_8M
Wavelength(s)	1.000031
Spacegroup name	P 21 21 21
Unit cell lengths	51.100, 107.220, 152.630
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.773 - 1.750
R-factor	0.1795
Rwork	0.178
R-free	0.21900
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.273
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.10_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000
High resolution limit [Å]	1.750	1.750
Number of reflections	84326
<I/σ(I)>	19.31
Completeness [%]	98.7
Redundancy	7.42
CC(1/2)	0.999

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	0.1 M MES, pH 6.0-6.5, 1.6-2.0 M ammonium sulfate, 2-10% 1,4-dioxane