9PI2

X-ray crystal structure of Ancylobacter lacus LanM bound to Nd(III) and Ca(II)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-2
Synchrotron site	NSLS-II
Beamline	17-ID-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-09-24
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97934
Spacegroup name	P 1 21 1
Unit cell lengths	40.242, 76.377, 42.671
Unit cell angles	90.00, 113.35, 90.00

Refinement procedure

Resolution	38.190 - 0.990
R-factor	0.136
Rwork	0.136
R-free	0.14360
Structure solution method	SAD
RMSD bond length	0.004
RMSD bond angle	0.806
Data reduction software	autoPROC
Data scaling software	autoPROC
Phasing software	PHENIX
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.190	1.030
High resolution limit [Å]	0.990	0.990
Number of reflections	1000252	1368
<I/σ(I)>	11.6
Completeness [%]	76.9
Redundancy	1.9
CC(1/2)	0.993	0.627

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	294	200 mM ammonium sulfate, 30 % (w/v) PEG 4000