4CS6

Crystal structure of AadA - an aminoglycoside adenyltransferase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-4
Synchrotron site	ESRF
Beamline	ID14-4
Temperature [K]	193
Detector technology	CCD
Collection date	2013-03-06
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0, 0.9793
Spacegroup name	P 21 2 21
Unit cell lengths	48.658, 58.642, 104.587
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.029 - 2.502
R-factor	0.1962
Rwork	0.194
R-free	0.25210
Structure solution method	SAD
Starting model (for MR)	NONE
RMSD bond length	0.008
RMSD bond angle	1.277
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((PHENIX.REFINE))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.000	2.650
High resolution limit [Å]	2.500	2.500
Rmerge	0.080	0.950
Number of reflections	10853
<I/σ(I)>	17	2.1
Completeness [%]	99.7	98.5
Redundancy	7.05	7.14

Crystallization Conditions

crystal ID	method	pH	temperature	details
1