7VNT

Structure of aminotransferase-substrate complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NW12A
Synchrotron site	Photon Factory
Beamline	AR-NW12A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-11-30
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	1.0
Spacegroup name	P 65 2 2
Unit cell lengths	113.747, 113.747, 289.562
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	49.300 - 1.920
R-factor	0.1827
Rwork	0.181
R-free	0.21500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2eo5
RMSD bond length	0.011
RMSD bond angle	1.653
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.950
High resolution limit [Å]	1.920	5.210	1.920
Rmerge	0.126	0.065	1.163
Rmeas	0.129	0.067	1.196
Rpim	0.029	0.016	0.276
Total number of observations	1640839
Number of reflections	84821	4682	4147
<I/σ(I)>	4
Completeness [%]	99.5	99.1	99
Redundancy	19.3	17.8	18.4
CC(1/2)		0.998	0.861

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	293	PEG 3000, MgCl2, cacodylate