5MKP

Non redox thiolation in transfer RNAs occuring via sulfur activation by a [4Fe-4S] cluster

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	80
Detector technology	PIXEL
Collection date	2016-04-08
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.979338
Spacegroup name	P 43 21 2
Unit cell lengths	70.120, 70.120, 127.900
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.250 - 2.500
R-factor	0.195
Rwork	0.193
R-free	0.24500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3vrh
RMSD bond length	0.009
RMSD bond angle	1.000
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	BUSTER (2.10.2)

Data quality characteristics

	Outer shell
Low resolution limit [Å]	2.650
High resolution limit [Å]	2.500
Rmerge	2.770
<I/σ(I)>	1
Completeness [%]	99.7
Redundancy	13.9
CC(1/2)	0.290

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	9	298	Anaerobic conditions (Glovebox)