7MJW

Methylated MiaB in the complex with 5'-deoxyadenosine, methionine and RNA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-10-25
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0033
Spacegroup name	P 1 21 1
Unit cell lengths	68.900, 97.413, 80.738
Unit cell angles	90.00, 108.08, 90.00

Refinement procedure

Resolution	39.080 - 1.400
R-factor	0.1497
Rwork	0.149
R-free	0.17370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2qgq
RMSD bond length	0.018
RMSD bond angle	1.848
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.430
High resolution limit [Å]	1.350	3.660	1.400
Rmerge	0.064	0.030	0.882
Rmeas	0.071	0.034	0.977
Rpim	0.030	0.014	0.417
Number of reflections	308607	11290	11074
<I/σ(I)>	9.5
Completeness [%]	99.9	99.7	99.9
Redundancy	5.5	5.5	5.3
CC(1/2)		0.998	0.716

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	100 mM sodium cacodylate pH 5.5, 13% PEG 4000, 1,2-butanediol