2UXO

TtgR in complex with Tetracycline

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	CCD
Detector	ADSC CCD
Spacegroup name	P 21 21 2
Unit cell lengths	46.176, 232.399, 44.031
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.020 - 2.700
R-factor	0.23138
Rwork	0.231
R-free	0.29360
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.016
RMSD bond angle	1.645
Data reduction software	MOSFLM
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.700	2.700
Rmerge	0.100	0.380
Number of reflections	12692
<I/σ(I)>	22.3	6.9
Completeness [%]	92.9	98.9
Redundancy	5.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		6.5		0.2 M MGCL2, 0.1 M BIS-TRIS PH 6.5, 10%(V/V) PEG3350