8GAJ

Crystal Structure of E. coli LptA in complex with Podisus maculiventris Thanatin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-07-24
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97918
Spacegroup name	P 21 21 21
Unit cell lengths	44.950, 61.830, 150.330
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.750 - 2.430
R-factor	0.196
Rwork	0.194
R-free	0.24160
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.617
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.750	2.517
High resolution limit [Å]	2.430	2.430
Number of reflections	16463	1614
<I/σ(I)>	23.27
Completeness [%]	99.9
Redundancy	11.5
CC(1/2)	0.999	0.980

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.8	293	0.025 M Tris pH 8.5, 100 mM NaCl, 0.05 M MES pH 5.8, 35% MPD