6BGM

Crystal structure of ferrous form of the crosslinked human cysteine dioxygenase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-01-14
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1
Spacegroup name	P 65
Unit cell lengths	131.757, 131.757, 34.262
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	32.939 - 2.206
R-factor	0.183
Rwork	0.179
R-free	0.21600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2ic1
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.260
High resolution limit [Å]	2.200	5.170	2.200
Rmerge	0.185	0.114	0.839
Rmeas	0.198	0.122	0.912
Rpim	0.069	0.043	0.349
Number of reflections	17488	1422	1345
<I/σ(I)>	5.2
Completeness [%]	99.9	98.9	100
Redundancy	8.1	8.1	6.6
CC(1/2)		0.992	0.823

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	0.1 M MES, 2 M ammonium sulfate, 2% PEG400