8J44

Reductive Aminase RA34-WT

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SEALED TUBE
Source details	BRUKER D8 QUEST
Temperature [K]	150
Detector technology	PIXEL
Collection date	2022-11-25
Detector	Bruker PHOTON II
Wavelength(s)	1.54178
Spacegroup name	P 1 21 1
Unit cell lengths	69.732, 55.772, 86.053
Unit cell angles	90.00, 106.05, 90.00

Refinement procedure

Resolution	23.250 - 2.250
R-factor	0.19715
Rwork	0.195
R-free	0.23015
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.479
Data reduction software	PROTEUM PLUS
Data scaling software	PROTEUM PLUS
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	23.250	2.320
High resolution limit [Å]	2.250	2.250
Rpim	0.047	0.266
Number of reflections	30171	2558
<I/σ(I)>	12.9
Completeness [%]	99.1
Redundancy	4.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.4	289.2	Tacsimate, MES monohydrate, PEG 4000