5X3T

VapBC from Mycobacterium tuberculosis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2014-09-29
Detector	ADSC QUANTUM 270
Wavelength(s)	0.97935
Spacegroup name	P 41
Unit cell lengths	64.221, 64.221, 216.134
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.780 - 2.650
R-factor	0.21
Rwork	0.208
R-free	0.23900
Structure solution method	SAD
RMSD bond length	0.006
RMSD bond angle	1.178
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	AutoSol
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.700
High resolution limit [Å]	2.650	2.650
Number of reflections	49908
<I/σ(I)>	70.2
Completeness [%]	99.8
Redundancy	24.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	Tacsimate