6O5U

AAC-VIa bound to Kanamycin A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-03-13
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.0
Spacegroup name	C 1 2 1
Unit cell lengths	87.271, 86.282, 50.193
Unit cell angles	90.00, 119.96, 90.00

Refinement procedure

Resolution	40.129 - 1.400
R-factor	0.13
Rwork	0.129
R-free	0.15580
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6bbz
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.430
High resolution limit [Å]	1.394	3.450	1.400
Rmerge	0.043	0.033	0.380
Rmeas	0.051	0.040	0.461
Rpim	0.028	0.022	0.258
Number of reflections	63478	4311	4208
<I/σ(I)>	7.3
Completeness [%]	99.5	99.5	99.4
Redundancy	3.4	3.4	3
CC(1/2)		0.997	0.891

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		279	15-20% PEG 8000, 0.1M Tris pH 8.5 and 0.3M MgCl2