1R7R

The crystal structure of murine p97/VCP at 3.6A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-4
Synchrotron site	ESRF
Beamline	ID14-4
Temperature [K]	200
Detector technology	CCD
Collection date	2002-05-20
Detector	ADSC QUANTUM 4
Wavelength(s)	0.9292
Spacegroup name	P 6 2 2
Unit cell lengths	145.200, 145.200, 167.400
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	25.000 * - 3.600
R-factor	0.327
Rwork	0.327
R-free	0.35800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1e32
RMSD bond length	0.010
RMSD bond angle	23.800 *
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.000	3.660
High resolution limit [Å]	3.600	3.600
Rmerge	0.085	0.238
Total number of observations	133872 *
Number of reflections	12461
<I/σ(I)>	17.4	5.3
Completeness [%]	99.8 *	100 *
Redundancy	10.66

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.6	293	1.0-1.4M ammonium phosphate (monobasic), 1-5% PEG 400, 2mM BMe, 0.1M sodium citrate, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	7 (mg/ml)
10	1	reservoir	sodium citrate	0.1	pH5.6
2	1	drop	HEPES	25 (mM)
3	1	drop		250 (mM)
4	1	drop	beta-mercaptoethanol	2 (mg/ml)
5	1	drop		1 (mM)
6	1	drop	AMP-PNP	10 (mM)	or 2'-BrAMP-PNP
7	1	reservoir	ammonium phosphate	1.0-1.4 (M)
8	1	reservoir	PEG400	1-5 (%)
9	1	reservoir	beta-mercaptoethanol	2 (mM)