5LTM

Crystal structure of phenylalanine ammonia-lyase from Anabaena variabilis (Y78F-C503S-C565S) bound to cinnamate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	180
Detector technology	PIXEL
Collection date	2015-02-04
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.987
Spacegroup name	P 43 2 2
Unit cell lengths	78.077, 78.077, 354.492
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.829 - 2.413
R-factor	0.1586
Rwork	0.156
R-free	0.20560
RMSD bond length	0.009
RMSD bond angle	1.312
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall
Low resolution limit [Å]	29.829
High resolution limit [Å]	2.410
Number of reflections	552678
<I/σ(I)>	3
Completeness [%]	99.7
Redundancy	12.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	12-20% PEG1500 100mM SPG (Succinic acid dihydrogen phosphate glycine (pH7.0)