4FJV

Crystal Structure of Human Otubain2 and Ubiquitin Complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2011-05-12
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.9173
Spacegroup name	P 21 21 21
Unit cell lengths	54.063, 76.825, 198.847
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.712 - 2.047
R-factor	0.2088
Rwork	0.206
R-free	0.26720
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1TFF and 3N32
RMSD bond length	0.007
RMSD bond angle	1.035
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	PHENIX ((phenix.refine: 1.7.3_928))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.120
High resolution limit [Å]	2.047	2.050
Rmerge	0.168	0.627
Number of reflections	52092
<I/σ(I)>	11	2.5
Completeness [%]	99.1	96.1
Redundancy	9	6.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	279	15 % (w/v) Polyethylene Glycol 3350, 0.1 M Magnesium Formate , pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 279K
1	VAPOR DIFFUSION, SITTING DROP	8	279	15 % (w/v) Polyethylene Glycol 3350, 0.1 M Magnesium Formate , pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 279K