3L11

Crystal Structure of the Ring Domain of RNF168

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E SUPERBRIGHT
Temperature [K]	100
Detector technology	CCD
Collection date	2009-11-11
Detector	RIGAKU SATURN A200
Wavelength(s)	1.54
Spacegroup name	P 43 21 2
Unit cell lengths	49.706, 49.706, 110.149
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.490 - 2.120
R-factor	0.1887
Rwork	0.187
R-free	0.21477
Structure solution method	S-SAD coupled with molecular replacement
Starting model (for MR)	3fl2
RMSD bond length	0.024
RMSD bond angle	2.423
Data reduction software	XDS
Data scaling software	XDS
Phasing software	SHELXD
Refinement software	REFMAC (5.6.0041)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.310	2.220
High resolution limit [Å]	2.120	2.120
Rmerge	0.124	0.649
Number of reflections	8384
<I/σ(I)>	40.1	5.17
Completeness [%]	99.4	99.7
Redundancy	53.39	54.28

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.3	291	1.5 M NaMalonate, pH 7.3, VAPOR DIFFUSION, HANGING DROP, temperature 291K