5XHS

Crystal structure of SIRT5 complexed with a fluorogenic small-molecule substrate SuBKA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-02-20
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1
Spacegroup name	P 21 2 21
Unit cell lengths	42.130, 55.274, 124.303
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.901 - 2.190
R-factor	0.1759
Rwork	0.173
R-free	0.22430
RMSD bond length	0.012
RMSD bond angle	1.204
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155))

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.190
Number of reflections	15515
<I/σ(I)>	10
Completeness [%]	99.7
Redundancy	9.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	293	23% PEG 3350, 0.1 M Bis-Tris pH 5.5, 0.2M NaCl