2ZXV

Crystal structure of putative acetyltransferase from T. thermophilus HB8

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E+ SUPERBRIGHT
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2005-04-12
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5418
Spacegroup name	I 4
Unit cell lengths	127.800, 127.800, 122.100
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.130 - 2.300
Rwork	0.228
R-free	0.26600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2z10
RMSD bond length	0.003
RMSD bond angle	0.700
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.380
High resolution limit [Å]	2.300	2.300
Number of reflections	42723
<I/σ(I)>	28.7	8.5
Completeness [%]	97.8	82.3
Redundancy	14.5	10.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293	25% PEG 3350, 0.2M MgCl, 0.1M BisTris, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K