7QX3

Structure of the transaminase TR2E2 with EOS

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P13 (MX1)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-05-05
Detector	DECTRIS EIGER R 4M
Wavelength(s)	0.9762
Spacegroup name	P 21 21 21
Unit cell lengths	100.610, 109.502, 211.455
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.940 - 3.600
Rwork	0.161
R-free	0.21830
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7qx0
RMSD bond length	0.017
RMSD bond angle	1.769
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.940	3.729
High resolution limit [Å]	3.600	3.600
Number of reflections	27774	2733
<I/σ(I)>	15.38
Completeness [%]	99.8
Redundancy	13
CC(1/2)	0.997	0.977

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		278	4% (w/v) PEG 6000, 100 mM citric acid pH 4