9BJ7

Crystal structure of the N-terminal truncated AbiV (residues 24-201)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 31-ID
Synchrotron site	APS
Beamline	31-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-10-28
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.97931
Spacegroup name	P 1
Unit cell lengths	74.444, 106.901, 146.228
Unit cell angles	90.96, 89.95, 95.02

Refinement procedure

Resolution	106.700 - 2.640
R-factor	0.2275
Rwork	0.225
R-free	0.26836
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.741
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	146.210	2.780
High resolution limit [Å]	2.640	2.640
Rmerge	0.089	0.766
Rmeas	0.106	0.909
Rpim	0.055	0.483
Total number of observations	429479	58190
Number of reflections	122595	17651
<I/σ(I)>	8.1	2
Completeness [%]	92.9
Redundancy	3.5	3.3
CC(1/2)	0.998	0.815

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH		295	0.2 M Lithium sulfate, 0.1 M TRIS pH 8.5, 30% (w/v) PEG 4000