5WGI

Ultrahigh resolution crystal structure of Danio rerio histone deacetylase 6 catalytic domain 2 in complex with TSA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-07-07
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.97920
Spacegroup name	P 1 21 1
Unit cell lengths	48.439, 69.639, 50.193
Unit cell angles	90.00, 110.42, 90.00

Refinement procedure

Resolution	47.038 - 1.050
R-factor	0.1072
Rwork	0.106
R-free	0.12550
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5eem
RMSD bond length	0.009
RMSD bond angle	1.148
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((dev_2776: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.040
High resolution limit [Å]	1.050	1.050
Number of reflections	138710
<I/σ(I)>	11.1
Completeness [%]	95.6
Redundancy	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	magnesium chloride, Bis-Tris, pH 6.5, PEG3350