6JIF

Crystal Structures of Branched-Chain Aminotransferase from Pseudomonas sp. UW4

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	97
Detector technology	PIXEL
Collection date	2018-10-02
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9790
Spacegroup name	P 21 21 21
Unit cell lengths	71.825, 95.717, 109.824
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.858 - 1.700
R-factor	0.1829
Rwork	0.182
R-free	0.22250
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3uyy
RMSD bond length	0.015
RMSD bond angle	1.325
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.14_3260: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.860	1.760
High resolution limit [Å]	1.700	1.700
Rmerge	0.108	0.982
Rmeas	0.111	1.066
Rpim	0.031	0.286
Number of reflections	83772	6091
<I/σ(I)>	16.57	2.86
Completeness [%]	99.9	99
Redundancy	12.8	12.3
CC(1/2)	0.999	0.839

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.25M Ammonium citrate dibasic, 20%(w/v) polyethylene glycol 3350