5OJ7

Sirtuin 4 orthologue from Xenopus Tropicalis in complex with ADP-ribose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	CCD
Collection date	2015-07-02
Detector	RAYONIX MX-225
Wavelength(s)	0.911656
Spacegroup name	C 2 2 21
Unit cell lengths	69.390, 74.660, 109.700
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.730 - 1.580
R-factor	0.15411
Rwork	0.152
R-free	0.18648
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4twi
RMSD bond length	0.030
RMSD bond angle	2.608
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER (2.5.6.)
Refinement software	REFMAC (5.8.0103)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	1.620
High resolution limit [Å]	1.580	1.580
Rmeas	0.036	0.853
Number of reflections	39280	2868
<I/σ(I)>	23.7
Completeness [%]	99.8	99.9
Redundancy	5.1	5.2
CC(1/2)	1.000	0.700

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	277	0.1 M BICINE pH 8.0 17% PEG6000