5GT8

Crystal Structure of apo-CASTOR1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2016-05-18
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9791
Spacegroup name	P 1 21 1
Unit cell lengths	47.410, 142.600, 95.400
Unit cell angles	90.00, 90.26, 90.00

Refinement procedure

Resolution	47.410 - 2.800
R-factor	0.244
Rwork	0.243
R-free	0.26500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5gt7
RMSD bond length	0.003
RMSD bond angle	0.590
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.10.1_2155: ???)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	142.598	142.598	2.860
High resolution limit [Å]	2.700	8.080	2.700
Rmerge	0.079	0.022	0.590
Number of reflections	34540
<I/σ(I)>	12.89	39.02	2.11
Completeness [%]	98.9	98.3	96.2
Redundancy	3.72
CC(1/2)	0.998	0.999	0.885

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	21%(w/v) PEG3350, 0.1M Tris pH 5.0, 0.2M MgCl2, 0.2% n- dodecyl- N, N- dimethylamine-N-oxide