7QYG

Structure of the transaminase TR2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-07-16
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.976251
Spacegroup name	P 21 21 21
Unit cell lengths	60.776, 166.626, 209.821
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.090 - 3.600
Rwork	0.345
R-free	0.42200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	own model
RMSD bond length	0.007
RMSD bond angle	1.042
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.17)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.090	3.729
High resolution limit [Å]	3.600	3.600
Number of reflections	24144	1812
<I/σ(I)>	10.23	1.95
Completeness [%]	94.2
Redundancy	2
CC(1/2)	1.000	0.887

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		298	4% (w/v) PEG 6000, 100 mM citric acid pH 4