5Z8K

Crystal structure of an aminotransferase in complex with product-1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2017-04-26
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97960
Spacegroup name	P 21 21 21
Unit cell lengths	77.847, 89.157, 117.364
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.298 - 1.759
R-factor	0.1819
Rwork	0.181
R-free	0.22680
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5z83
RMSD bond length	0.007
RMSD bond angle	0.861
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (dev_2474)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.790
High resolution limit [Å]	1.759	1.760
Rmerge	0.069	0.299
Rpim	0.023	0.143
Number of reflections	74626	2380
<I/σ(I)>	28.6
Completeness [%]	92.2
Redundancy	9.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH		295	magnesium formate, PEG3350