4L7W

Crystal structure mutant H77A of human HD domain-containing protein 2, Genomics Consortium (NESG) Target HR6723

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X4A
Synchrotron site	NSLS
Beamline	X4A
Temperature [K]	100
Detector technology	CCD
Collection date	2012-11-06
Detector	ADSC QUANTUM 4
Wavelength(s)	0.979
Spacegroup name	I 41 2 2
Unit cell lengths	71.380, 71.380, 199.308
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.690 - 2.305
R-factor	0.1763
Rwork	0.174
R-free	0.22810
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4dmb
RMSD bond length	0.008
RMSD bond angle	1.101
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	BALBES
Refinement software	PHENIX (dev_1269)

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.300
Rmerge	0.096
Number of reflections	11866
<I/σ(I)>	40.9
Completeness [%]	100.0
Redundancy	8.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	microbatch under oil	8	277	Protein solution: 100mM NaCl, 5mM DTT, 0.02% NaN3, 10mM Tris-HCl (pH 7.5) . Reservoir solution: 0.1M Mg(NO3)2, 0.1M Tris, 12% PEG 20000, microbatch under oil, temperature 277K