6TC5

Phytochromobilin-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	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-09-02
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9184
Spacegroup name	P 31 2 1
Unit cell lengths	133.875, 133.875, 46.951
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	43.820 - 2.100
Rwork	0.197
R-free	0.22950
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6tby
RMSD bond length	0.010
RMSD bond angle	1.870
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]	43.820	2.160
High resolution limit [Å]	2.100	2.100
Rmerge	0.151	1.620
Rmeas	0.175	1.873
Rpim	0.088	0.933
Number of reflections	28169	2275
<I/σ(I)>	10.7	1.3
Completeness [%]	99.1	98.5
Redundancy	7.4	7.7
CC(1/2)	0.997	0.536

Crystallization Conditions

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