8VZC

Crystal Structure of 2-Hydroxyacyl-CoA Lyase/Synthse ApbHACS from Alphaproteobacteria bacterium in the Complex with THDP, Formyl-CoA, and ADP

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-04-14
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0328
Spacegroup name	P 1
Unit cell lengths	69.084, 102.442, 103.977
Unit cell angles	113.83, 96.81, 105.45

Refinement procedure

Resolution	38.630 - 1.720
R-factor	0.1634
Rwork	0.162
R-free	0.19760
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.015
RMSD bond angle	1.392
Data reduction software	XDS
Data scaling software	XDS
Phasing software	HKL-3000
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	87.920	1.810
High resolution limit [Å]	1.720	1.720
Rmerge	0.070	0.429
Rmeas	0.088	0.530
Rpim	0.054	0.319
Number of reflections	238150	26539
<I/σ(I)>	7.2	1.8
Completeness [%]	92.3	69.7
Redundancy	2.7	2.6
CC(1/2)	0.996	0.836

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	289	0.2 M sodium sulfate, 0.1 M Bis-Tris Propane pH 7.5, 20 % (w/v) PEG 3350