7TB6

Structure of S. maltophilia CapW

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-04-25
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.00003
Spacegroup name	P 65 2 2
Unit cell lengths	113.033, 113.033, 188.220
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	67.840 - 1.890
R-factor	0.1965
Rwork	0.196
R-free	0.21440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7tb5
RMSD bond length	0.010
RMSD bond angle	0.975
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	94.200	1.940
High resolution limit [Å]	1.890	1.890
Rmerge	0.131	2.736
Rmeas	0.135	2.837
Number of reflections	57481	4176
<I/σ(I)>	14.1	1
Completeness [%]	100.0	100
Redundancy	18.3	14.3
CC(1/2)	0.999	0.552

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M Tris pH 8.5, 1.5 M Lithium sulfate