1MI1

Crystal Structure of the PH-BEACH Domain of Human Neurobeachin

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	APS BEAMLINE 32-ID
Synchrotron site	APS
Beamline	32-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2001-06-01
Detector	MARRESEARCH
Wavelength(s)	0.9764, 0.9793, 0.9791, 0.9686
Spacegroup name	P 61
Unit cell lengths	179.910, 179.910, 98.540
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.000 * - 2.900
R-factor	0.23
Rwork	0.230
R-free	0.26400
Structure solution method	MAD
RMSD bond length	0.008
RMSD bond angle	23.200 *
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	MADSYS
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	3.000
High resolution limit [Å]	2.900	2.900
Rmerge	0.079 *
Total number of observations	355843 *
Number of reflections	80025 *
Completeness [%]	99.2	98.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.6	4 *	Tris, 10mM DTT, 4% PEG 8000, pH 7.6, VAPOR DIFFUSION, SITTING DROP at 277K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	reservoir	Tris	100 (mM)	pH7.6
2	1	reservoir	PEG8000	4 (%(w/v))
3	1	reservoir	dithiothreitol	2 (mM)
4	1	drop	Tris	20 (mM)	pH8.5
5	1	drop		200 (mM)
6	1	drop	dithiothreitol	10 (mM)
7	1	drop	protein	30 (mg/ml)