2PFR

Human N-acetyltransferase 2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2006-09-07
Detector	RIGAKU RAXIS
Wavelength(s)	1.5418
Spacegroup name	P 43 21 2
Unit cell lengths	130.063, 130.063, 111.230
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 1.920
Rwork	0.209
R-free	0.24530
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2ija
RMSD bond length	0.017
RMSD bond angle	1.405
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	REFMAC (refmac_5.2.0019)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	30.000	30.000	1.990
High resolution limit [Å]	1.920	4.130	1.920
Rmerge	0.133	0.044	0.997
Number of reflections	139603	14002	13946
<I/σ(I)>	7.9
Completeness [%]	100.0
Redundancy	7.4	7.8	6.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	291	2.5 M Ammonium sulfate, 0.1M TRIS, pH 8.5, vapor diffusion, sitting drop, temperature 291K
1	VAPOR DIFFUSION, SITTING DROP	8.5	291	2.5 M Ammonium sulfate, 0.1M TRIS, pH 8.5, vapor diffusion, sitting drop, temperature 291K