3GZ1

Crystal structure of IpgC in complex with the chaperone binding region of IpaB

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.2
Synchrotron site	BESSY
Beamline	14.2
Temperature [K]	100
Detector technology	CCD
Collection date	2007-08-09
Detector	MAR CCD 165 mm
Wavelength(s)	0.91841
Spacegroup name	C 2 2 21
Unit cell lengths	73.310, 97.090, 106.530
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.370 - 2.150
R-factor	0.201
Rwork	0.200
R-free	0.23000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3gyz
RMSD bond length	0.024
RMSD bond angle	2.069
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC (5.5.0044)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.370	2.210
High resolution limit [Å]	2.150	2.150
Rmerge	0.154	0.680
Number of reflections	19676	1316
<I/σ(I)>	13.17	2
Completeness [%]	93.5	86.5
Redundancy	8.7	4.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.4	291	0.1M HEPES, 20% PEG 8000, 8% ethylene glycol, pH7.4, VAPOR DIFFUSION, HANGING DROP, temperature 291K
1	VAPOR DIFFUSION, HANGING DROP	7.4	291	0.1M HEPES, 20% PEG 8000, 8% ethylene glycol, pH7.4, VAPOR DIFFUSION, HANGING DROP, temperature 291K