6L71

Sirtuin 2 demyristoylation native intermediate I & II mixture

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2019-03-23
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97930
Spacegroup name	P 1 21 1
Unit cell lengths	37.601, 78.095, 56.347
Unit cell angles	90.00, 97.64, 90.00

Refinement procedure

Resolution	27.924 - 2.109
R-factor	0.1704
Rwork	0.167
R-free	0.22350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4r8m
RMSD bond length	0.009
RMSD bond angle	1.216
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.12_2829)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.150
High resolution limit [Å]	2.109	2.109
Number of reflections	18062	712
<I/σ(I)>	11	1.5
Completeness [%]	96.7
Redundancy	5.9
CC(1/2)	0.989	0.601

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	291	0.1M MES, pH 6.5, 6%-20% (w/v) PEG 10000