4QII

Crystal Structure of type II MenB from Mycobacteria tuberculosis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2013-11-11
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9792
Spacegroup name	P 1 21 1
Unit cell lengths	91.470, 147.720, 140.820
Unit cell angles	90.00, 103.45, 90.00

Refinement procedure

Resolution	34.955 - 1.640
R-factor	0.1523
Rwork	0.151
R-free	0.18120
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1q52
RMSD bond length	0.006
RMSD bond angle	1.078
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8.4_1496))

Data quality characteristics

	Overall
Low resolution limit [Å]	34.960
High resolution limit [Å]	1.640
Number of reflections	439236

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	295	0.2M NaCl, 0.1M HEPES pH 8.5, 25% PEG 3350, VAPOR DIFFUSION, HANGING DROP, temperature 295K