5WAM

Structure of BamE from Neisseria gonorrhoeae

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-06-01
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.0000
Spacegroup name	P 21 21 2
Unit cell lengths	62.804, 86.075, 49.919
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.182 - 2.450
R-factor	0.2006
Rwork	0.199
R-free	0.24000
Structure solution method	SAD
RMSD bond length	0.002
RMSD bond angle	0.450
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	AutoSol
Refinement software	PHENIX (dev_2722)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.540
High resolution limit [Å]	2.450	5.280	2.450
Rmerge	0.160	0.096	0.795
Rmeas	0.184	0.110	0.915
Rpim	0.088	0.053	0.439
Total number of observations	43328
Number of reflections	10309
<I/σ(I)>	5.4
Completeness [%]	98.1	95.8	99.5
Redundancy	4.2	3.9	4.3
CC(1/2)		0.990	0.491

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	294	0.01M ZINC SULFATE, 0.1M MES PH 6.5, 25% PEG550MME