8BZ5

Crystal structure of the L. monocytogenes RmlT in complex with HEPES

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-11-09
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.980112
Spacegroup name	P 1 21 1
Unit cell lengths	82.081, 178.367, 92.154
Unit cell angles	90.00, 93.52, 90.00

Refinement procedure

Resolution	48.120 - 2.300
R-factor	0.1944
Rwork	0.193
R-free	0.22020
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	8bz4
RMSD bond length	0.004
RMSD bond angle	0.586
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.120	2.340
High resolution limit [Å]	2.300	2.300
Rmerge	0.112	1.295
Rmeas	0.121	1.396
Rpim	0.046	0.519
Number of reflections	116033	5688
<I/σ(I)>	10.7	1.4
Completeness [%]	99.2	98.4
Redundancy	7	7.2
CC(1/2)	0.998	0.596

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M HEPES-NaOH pH 7.5 20% (w/v) PEG 8,000