3HMY

Crystal structure of HCR/T complexed with GT2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2008-10-22
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5418
Spacegroup name	P 21 21 21
Unit cell lengths	66.960, 72.690, 119.050
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.200 - 2.000
R-factor	0.202
Rwork	0.202
R-free	0.23700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB 1fv2
RMSD bond length	0.006
RMSD bond angle	1.300
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	27.200	2.070
High resolution limit [Å]	2.000	2.000
Number of reflections	39755
<I/σ(I)>	24.8	3.6
Completeness [%]	99.2	97.7
Redundancy	7	6.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	292	Bis-Tis propane buffer pH 7.0, 25% PEG2K and 300 mM Ammonium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 292K