6KHN

Crystal structure of Oryza sativa TDC with PLP and SEROTONIN

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-03-30
Detector	DECTRIS PILATUS3 R CdTe 300K
Wavelength(s)	0.97846
Spacegroup name	P 31 2 1
Unit cell lengths	156.274, 156.274, 102.392
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.884 - 2.293
R-factor	0.1646
Rwork	0.163
R-free	0.20180
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.380
High resolution limit [Å]	2.293	4.950	2.300
Rmerge	0.102	0.052	0.712
Rmeas	0.109	0.055	0.766
Rpim	0.038	0.018	0.278
Number of reflections	64622	6709	6412
<I/σ(I)>	12.1
Completeness [%]	99.9	99.9	100
Redundancy	8	8.8	7.5
CC(1/2)		0.998	0.891

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289.15	PEG 1000, Imidazole/Hydrochloric acid, Calcium acetate