9GZJ

Crystal structure of the L. monocytogenes RmlT in complex with 3-RboP-(CH2)6NH2

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-07-11
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979260
Spacegroup name	P 21 21 21
Unit cell lengths	83.248, 103.386, 178.560
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.620 - 2.340
R-factor	0.194
Rwork	0.192
R-free	0.22590
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.552
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]	48.420	2.390
High resolution limit [Å]	2.340	2.340
Rmerge	0.079	1.363
Rmeas	0.086	1.492
Rpim	0.033	0.601
Number of reflections	66054	4341
<I/σ(I)>	16.2	1.2
Completeness [%]	99.9	98.7
Redundancy	6.6	6
CC(1/2)	0.999	0.598

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M MES pH 6.5 0.15 M K/Na tartrate tetrahydrate 20% (w/v) PEG 3,350