6Q0P

P. mirabilis hemolysin A mutant - Y134S

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-BM
Synchrotron site	APS
Beamline	19-BM
Temperature [K]	100
Detector technology	CCD
Collection date	2015-12-05
Detector	ADSC QUANTUM 210r
Wavelength(s)	1.03
Spacegroup name	P 1 2 1
Unit cell lengths	59.742, 34.116, 68.359
Unit cell angles	90.00, 99.10, 90.00

Refinement procedure

Resolution	33.749 - 1.542
R-factor	0.1848
Rwork	0.183
R-free	0.21150
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4w8q
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.15_3459)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.749	1.590
High resolution limit [Å]	1.542	1.542
Rmerge	0.096	0.894
Rpim	0.039	0.413
Number of reflections	39365	3391
<I/σ(I)>	16.9	2
Completeness [%]	98.3	84.7
Redundancy	6.5	5.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5	298	PEG 4000