7L6J

Crystal Structure of the Putative Hydrolase from Stenotrophomonas maltophilia

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2020-06-19
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	0.97872
Spacegroup name	I 41 3 2
Unit cell lengths	171.693, 171.693, 171.693
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.450 - 1.780
R-factor	0.1382
Rwork	0.137
R-free	0.15440
Structure solution method	SAD
RMSD bond length	0.005
RMSD bond angle	1.376
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	HKL-3000
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.810
High resolution limit [Å]	1.780	1.780
Rmerge	0.111	0.886
Rmeas	0.117	0.931
Rpim	0.036	0.287
Number of reflections	41390	2047
<I/σ(I)>	23	3.3
Completeness [%]	99.9	100
Redundancy	10.3	10.4
CC(1/2)	0.994	0.851

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		292	Protein: 7.9 mg/ml, 0.5M Sodium chloride, 0.01M Tris pH 8.3; Screen: ComPAS (H12), 3.0M Sodium formate; Cryo: 4.0M Sodium formate.