7BU1

Crystal structure of TrmO from Pseudomonas aeruginosa

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-01-01
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9793
Spacegroup name	P 21 21 21
Unit cell lengths	56.841, 69.980, 128.202
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.270 - 2.490
R-factor	0.2292
Rwork	0.227
R-free	0.27310
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1xqb
RMSD bond length	0.006
RMSD bond angle	0.961
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.270	2.600
High resolution limit [Å]	2.490	2.490
Rmerge	0.147	1.405
Rmeas	0.153	1.465
Rpim	0.058	0.569
Number of reflections	18474	2045
<I/σ(I)>	16.2
Completeness [%]	99.9	99.2
Redundancy	12.9	12.5
CC(1/2)	0.999	0.802

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	0.1 M HEPES (pH 7.5), 1.2 M K2HPO4