7CS0

Aminoglycoside 2'-N-acetyltransferase from Mycolicibacterium smegmatis-Complex with Coenzyme A and Paromomycin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2019-11-06
Detector	ADSC QUANTUM 270
Wavelength(s)	0.97935
Spacegroup name	P 32
Unit cell lengths	56.374, 56.374, 122.866
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	28.200 - 2.050
R-factor	0.18564
Rwork	0.183
R-free	0.23323
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7crm
RMSD bond length	0.009
RMSD bond angle	1.643
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.090
High resolution limit [Å]	2.050	2.050
Rmerge	0.101	0.266
Number of reflections	27416	1389
<I/σ(I)>	31.56
Completeness [%]	99.9	100
Redundancy	5.6	5.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	0.2M calcium acetate hydrate, 0.1M HEPES (pH 7.5), 10% (w/v) PEG 8000