4W8Q

Crystal structure of truncated hemolysin A from P. mirabilis at 1.4 Angstroms resolution

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2014-07-03
Detector	MAR scanner 300 mm plate
Wavelength(s)	1.03
Spacegroup name	P 1 2 1
Unit cell lengths	59.719, 34.317, 68.309
Unit cell angles	90.00, 99.21, 90.00

Refinement procedure

Resolution	29.658 - 1.428
R-factor	0.1401
Rwork	0.139
R-free	0.16290
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3fy3
RMSD bond length	0.016
RMSD bond angle	1.523
Refinement software	PHENIX ((phenix.refine: 1.9_1692))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.700	1.460
High resolution limit [Å]	1.428	1.428
Rmerge	0.078	0.814
Number of reflections	49625
<I/σ(I)>	25.4	2.2
Completeness [%]	97.2	74.9
Redundancy	6.9	4.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	298	100 mM citrate pH 5.5, 100 mM NaCl, PEG 4000 (8 - 16%)