6TBY

Phycocyanobilin-adducted PAS-GAF bidomain of Sorghum bicolor phyB

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE BM30A
Synchrotron site	ESRF
Beamline	BM30A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-14
Detector	DECTRIS EIGER X 4M
Wavelength(s)	0.9677
Spacegroup name	P 31 2 1
Unit cell lengths	134.738, 134.738, 46.543
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	44.100 - 1.800
Rwork	0.179
R-free	0.21180
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4our
RMSD bond length	0.012
RMSD bond angle	1.773
Data reduction software	XDS (Mar 15 2019)
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0257)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.100	1.840
High resolution limit [Å]	1.800	1.800
Rmerge	0.082	2.726
Rmeas	0.086	2.858
Rpim	0.026	0.858
Number of reflections	44840	2647
<I/σ(I)>	22.2	1.5
Completeness [%]	99.4	100
Redundancy	20.3	21.3
CC(1/2)	1.000	0.646

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	283.15	(100 mM Tris/HCl pH 8.5, 500 mM NaCl, 9% w/v PEG4000