9RVX

Structure of CrtA with citrate

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-06-15
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.918401
Spacegroup name	P 1
Unit cell lengths	67.143, 67.900, 102.518
Unit cell angles	89.27, 80.30, 68.56

Refinement procedure

Resolution	26.000 - 2.295
R-factor	0.2353
Rwork	0.234
R-free	0.27220
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.950
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	MOLREP
Refinement software	BUSTER (2.10.4)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	100.908	2.593
High resolution limit [Å]	2.295	2.295
Number of reflections	38618	1931
<I/σ(I)>	4.3
Completeness [%]	88.2
Redundancy	1.7
CC(1/2)	0.993	0.731

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M Na-Citrate pH5.5 16% PEG4K 10% isopropanol