8D5R

Structure of Y430F D-ornithine/D-lysine decarboxylase complex with D-ornithine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-11-17
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0000
Spacegroup name	C 1 2 1
Unit cell lengths	141.530, 50.200, 140.280
Unit cell angles	90.00, 116.00, 90.00

Refinement procedure

Resolution	37.340 - 1.440
R-factor	0.165
Rwork	0.165
R-free	0.19030
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6N2H.pdb
RMSD bond length	0.010
RMSD bond angle	1.071
Data reduction software	autoPROC
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.340	1.491
High resolution limit [Å]	1.440	1.440
Number of reflections	160330	15778
<I/σ(I)>	12.7	0.79
Completeness [%]	99.8
Redundancy	20
CC(1/2)	0.998	0.374

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M HEPES, pH 7.5, 0.2 M NaOAc, 20% PEG 4000