2VGZ

CRYSTAL STRUCTURE OF HUMAN KYNURENINE AMINOTRANSFERASE II

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-1
Synchrotron site	ESRF
Beamline	ID14-1
Temperature [K]	100
Detector technology	CCD
Detector	ADSC CCD
Spacegroup name	P 21 21 2
Unit cell lengths	99.631, 154.956, 61.201
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.590 - 2.300
R-factor	0.185
Rwork	0.182
R-free	0.24300
Structure solution method	SAD
Starting model (for MR)	NONE
RMSD bond length	0.018
RMSD bond angle	1.675
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	SHELX-SHARP
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.420
High resolution limit [Å]	2.300	2.300
Rmerge	0.070	0.180
Number of reflections	41797
<I/σ(I)>	12.5	5.7
Completeness [%]	98.0	87
Redundancy	3.4	2.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1