1ENY

CRYSTAL STRUCTURE AND FUNCTION OF THE ISONIAZID TARGET OF MYCOBACTERIUM TUBERCULOSIS

Experimental procedure

Spacegroup name	P 62 2 2
Unit cell lengths	100.140, 100.140, 140.450
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	? - 2.200
R-factor	0.196
Rwork	0.196
RMSD bond length	0.020
RMSD bond angle	2.100
Phasing software	X-PLOR
Refinement software	TNT

Data quality characteristics

	Overall
High resolution limit [Å]	2.200 *
Rmerge	0.096 *
Number of reflections	18462 *
Completeness [%]	81.0 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	enzyme	13 (mg/ml)
2	1	drop	NADH		in a 1:2 ratio with enzyme
3	1	reservoir	HEPES	50 (mM)
4	1	reservoir	MPD	8-12 (%)
5	1	reservoir	sodium citrate	50 (mM)