4OWO

Anthranilate phosphoribosyl transferase from Mycobacterium tuberculosis in complex with 6-fluoroanthranilate, PRPP and Magnesium

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	CCD
Collection date	2010-02-13
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.95369
Spacegroup name	P 21 21 21
Unit cell lengths	79.409, 92.099, 121.294
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	73.350 - 1.990
R-factor	0.1629
Rwork	0.161
R-free	0.19350
RMSD bond length	0.009
RMSD bond angle	1.441
Data scaling software	SCALA (3.3.15)
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	121.294	121.294	2.100
High resolution limit [Å]	1.993	6.300	1.990
Rmerge		0.043	0.494
Rmeas	0.119
Rpim	0.044	0.020	0.209
Total number of observations	446639	14402	64699
Number of reflections	61270
<I/σ(I)>	14	33.6	3.5
Completeness [%]	99.8	99.9	99.4
Redundancy	7.3	6.7	7.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	imidazole/malate, PEG 4000