7FJK

Tyrosine phenol-lyase from pantoea agglomerans

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B1
Synchrotron site	SPring-8
Beamline	BL26B1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-07-19
Detector	DECTRIS EIGER R 4M
Wavelength(s)	1.0
Spacegroup name	P 21 21 2
Unit cell lengths	111.516, 161.077, 100.146
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.840 - 1.300
R-factor	0.1292
Rwork	0.128
R-free	0.15470
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1c7g
RMSD bond length	0.005
RMSD bond angle	0.842
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.840	1.370
High resolution limit [Å]	1.300	1.300
Rmerge	0.063	0.446
Rmeas	0.073	0.515
Number of reflections	442369	70556
<I/σ(I)>	12.01	2.62
Completeness [%]	99.6	98.9
Redundancy	4.17	4.11
CC(1/2)	0.997	0.856

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	21 % PEG4000, 0.2 M Ammonium Acetate, 0.1 M Sodium Dihydrogen Citrate, 0.12 M Sodium Hydroxide