6QX6

Structure of gtPebB-dihydrobiliverdin complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-04-22
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.97898
Spacegroup name	P 1 21 1
Unit cell lengths	47.690, 77.690, 80.940
Unit cell angles	90.00, 91.99, 90.00

Refinement procedure

Resolution	47.661 - 1.650
R-factor	0.1837
Rwork	0.182
R-free	0.21100
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.709
Data reduction software	XDS (BUILT=20180126)
Data scaling software	XSCALE (BUILT=20180126)
Phasing software	PHASER (2.8.0)
Refinement software	PHENIX ((dev_3126: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.661	1.710
High resolution limit [Å]	1.650	1.650
Number of reflections	477875
<I/σ(I)>	9.71
Completeness [%]	98.1
Redundancy	6.9
CC(1/2)	0.998	0.445

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	279	0.1 M Tris pH 8.5, 32.5 % PEG 3350, 0.23 M ammonium sulfate