3E2F

Crystal structure of mouse kynurenine aminotransferase III, PLP-bound form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	100
Detector technology	CCD
Collection date	2008-06-27
Detector	ADSC QUANTUM 315
Wavelength(s)	1.0809
Spacegroup name	P 43 21 2
Unit cell lengths	91.820, 91.820, 233.649
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.210 - 2.590
R-factor	0.19585
Rwork	0.193
R-free	0.24643
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2zjg
RMSD bond length	0.025
RMSD bond angle	2.211
Data reduction software	DENZO
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	REFMAC (5.2.0005)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.690
High resolution limit [Å]	2.590	2.590
Rmerge	0.150	0.520
Number of reflections	29301
Completeness [%]	91.1
Redundancy	10.4	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	277	21% PEG 400, 150 mM CaCl2, 10% Glycerol, 100 mM HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K