5KYB

Crystal structure of the apo-form of USP7 catalytic domain [V302K] mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	CCD
Collection date	2016-03-09
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.98
Spacegroup name	P 1 21 1
Unit cell lengths	75.620, 68.280, 77.060
Unit cell angles	90.00, 95.99, 90.00

Refinement procedure

Resolution	56.719 - 2.200
R-factor	0.216
Rwork	0.213
R-free	0.27630
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1nb8
RMSD bond length	0.014
RMSD bond angle	1.198
Data reduction software	MOSFLM (7.1.1)
Data scaling software	Aimless (0.2.8)
Phasing software	PHASER (1.10.1)
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	56.720	56.720	2.270
High resolution limit [Å]	2.200	9.070	2.200
Rmerge	0.054	0.027	0.541
Rmeas	0.065
Rpim	0.035
Total number of observations	131027
Number of reflections	39712
<I/σ(I)>	10
Completeness [%]	99.6	99.7	99.3
Redundancy	3.3	3.5	3.3
CC(1/2)	0.999	0.999	0.805

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	292	1% Tryptone, 0.05M HEPES Na pH 7.0, 20% PEG3350