1VHG

Crystal structure of ADP compounds hydrolase

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	APS BEAMLINE 32-ID
Synchrotron site	APS
Beamline	32-ID
Detector technology	CCD
Detector	MARRESEARCH
Wavelength(s)	0.9795, 0.9641
Spacegroup name	I 41 3 2
Unit cell lengths	193.168, 193.168, 193.168
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.170 - 2.700
Rwork	0.211
R-free	0.27200
Structure solution method	Se-Met MAD phasing
RMSD bond length	0.011
RMSD bond angle	2.400 *
Data reduction software	MOSFLM
Data scaling software	SCALA
Refinement software	REFMAC (4.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.170	2.850
High resolution limit [Å]	2.700	2.700
Rmerge	0.149	0.500
Number of reflections	17164
<I/σ(I)>	29.9	10.5
Completeness [%]	100.0	100
Redundancy	43.9	44.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	7.5 *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	HEPES	10 (mM)	pH7.5
2	1	drop		150 (mM)
3	1	drop	methionine	10 (mM)
4	1	drop	glycerol	10 (%)
5	1	drop	dithiothreitol	5 (mM)
6	1	drop	protein	10 (mg/ml)