6J6T

Crystal Structure of HDA15 HD domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE TPS 05A
Synchrotron site	NSRRC
Beamline	TPS 05A
Temperature [K]	100
Detector technology	CCD
Collection date	2016-11-05
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.28198
Spacegroup name	P 1 21 1
Unit cell lengths	60.809, 78.833, 176.794
Unit cell angles	90.00, 94.22, 90.00

Refinement procedure

Resolution	29.520 - 2.360
R-factor	0.168
Rwork	0.167
R-free	0.21770
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3c0y
RMSD bond length	0.007
RMSD bond angle	0.929
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX (1.14_3260)
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	29.550	10.000	2.400
High resolution limit [Å]	2.360	6.400	2.360
Rmerge	0.091	0.038	0.473
Rmeas	0.111	0.047	0.578
Rpim	0.062	0.027	0.327
Number of reflections	67666	3438	3363
<I/σ(I)>	7.8
Completeness [%]	99.1	96.7	99.7
Redundancy	3.1	2.9	3
CC(1/2)		0.996	0.726

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	295	100mM Tris, 700mM LiSO4