12IS

Crystal structure of a SnoaL-like domain-containing protein from Mycobacterium ulcerans (Zinc Bound)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 19-ID
Synchrotron site	NSLS-II
Beamline	19-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2025-05-25
Detector	DECTRIS EIGER2 XE 9M
Wavelength(s)	0.9786
Spacegroup name	C 2 2 21
Unit cell lengths	62.071, 71.662, 56.341
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.050 - 1.310
R-factor	0.1503
Rwork	0.149
R-free	0.17420
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.039
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((2.0_5936: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.920	1.340
High resolution limit [Å]	1.310	1.310
Rmerge	0.043	1.010
Rmeas	0.045	1.079
Rpim	0.012	0.367
Total number of observations		10031
Number of reflections	53640	1234
<I/σ(I)>	26.4	1.7
Completeness [%]	92.0
Redundancy	12.6	8.1
CC(1/2)	1.000	0.757

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.2	291	12% 4000, 0.1M sodium acetate pH 4.2, 10mM dihdrogen potassium phosphate. MyulA.17060.a.A1.PB00143 at 15 mg/mL. Liu-S-182 drop CD/4, Puck: PSL-0405, Cryo: 32% PEG 4000, 0.2M sodium acetate pH 4.0