7SE9

Crystal structure of human Fibrillarin in complex with compound 1 from single soak

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	100
Detector technology	CCD
Collection date	2018-04-06
Detector	ADSC QUANTUM 210r
Wavelength(s)	0.9537
Spacegroup name	P 21 21 2
Unit cell lengths	67.605, 138.548, 68.967
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.880 - 1.750
R-factor	0.1881
Rwork	0.187
R-free	0.22160
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2ipx
RMSD bond length	0.010
RMSD bond angle	1.074
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.1_4122)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.880	1.780
High resolution limit [Å]	1.750	1.750
Rmerge	0.055	0.644
Rmeas	0.059	0.698
Rpim	0.022	0.257
Number of reflections	66058	3465
<I/σ(I)>	16.5
Completeness [%]	99.7
Redundancy	7.3
CC(1/2)	0.999	0.858

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	2.75-3.3 M Sodium Formate