5C21

Crystal structure of native HlyD from E. coli

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2013-06-23
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.99998
Spacegroup name	P 21 21 21
Unit cell lengths	77.615, 93.173, 163.388
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.878 - 2.500
R-factor	0.2367
Rwork	0.235
R-free	0.27440
RMSD bond length	0.004
RMSD bond angle	0.831
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall
Low resolution limit [Å]	20.000
High resolution limit [Å]	2.200
Number of reflections	58658
<I/σ(I)>	21.1
Completeness [%]	95.3
Redundancy	6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.8	287	80 mM Tris, 3% PGA-LM, 14% PEG 400