4F9J

Structure of Escherichia coli PgaB 42-655 in complex with iron

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	100
Detector technology	CCD
Collection date	2010-11-12
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9792
Spacegroup name	P 21 21 21
Unit cell lengths	91.055, 102.428, 150.901
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.528 - 2.103
R-factor	0.1659
Rwork	0.165
R-free	0.19830
Structure solution method	SAD
RMSD bond length	0.007
RMSD bond angle	1.035
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	SOLVE
Refinement software	PHENIX ((phenix.refine: 1.7.3_928))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.180
High resolution limit [Å]	2.100	2.100
Number of reflections	82493
Completeness [%]	99.9	99.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1