7REA

Apo Hemophilin from A. baumannii

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08B1-1
Synchrotron site	CLSI
Beamline	08B1-1
Temperature [K]	105
Detector technology	CCD
Collection date	2016-07-19
Detector	RAYONIX MX300HE
Wavelength(s)	0.9789
Spacegroup name	P 21 21 21
Unit cell lengths	44.260, 68.480, 71.040
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.566 - 1.490
R-factor	0.1472
Rwork	0.146
R-free	0.16730
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7red
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.570	1.530
High resolution limit [Å]	1.490	1.490
Number of reflections	35995	3549
<I/σ(I)>	17.43
Completeness [%]	100.0
Redundancy	14
CC(1/2)	0.999	0.910

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	4.5	293	30% (w/v) PEG8K, 0.1M sodium acetate pH 4.5, 0.2 M lithium sulfate