9GLB

Crystal Structure of Deacetylase (HdaH) from Klebsiella pneumoniae subsp. ozaenae

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.2
Synchrotron site	BESSY
Beamline	14.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-03-15
Detector	DECTRIS PILATUS3 S 2M
Wavelength(s)	0.918400
Spacegroup name	I 2 3
Unit cell lengths	147.163, 147.163, 147.163
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	26.010 - 2.100
R-factor	0.1525
Rwork	0.151
R-free	0.18060
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.832
Data reduction software	XDS (Jan 26, 2018 BUILT=20180808)
Data scaling software	XDS (Jan 26, 2018 BUILT=20180808)
Phasing software	PHASER (2.8.3)
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.540	2.160
High resolution limit [Å]	2.100	2.100
Rmerge	0.145	2.755
Rmeas	0.148	2.824
Rpim	0.033	0.622
Number of reflections	31019	2547
<I/σ(I)>	13.4	1.4
Completeness [%]	100.0	100
Redundancy	19.9	20.5
CC(1/2)	0.999	0.549

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	293	12% (w/v) PEG 8000, 10% (v/v) glycerol and 0.5M KCl