8YEM

Tubulin-RB3_SLD-TTL in complex with compound 9

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-07-19
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97853
Spacegroup name	P 21 21 21
Unit cell lengths	104.940, 156.810, 182.100
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.720 - 2.740
R-factor	0.2183
Rwork	0.217
R-free	0.28420
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.014
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.20_4459: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.720	2.810
High resolution limit [Å]	2.740	2.740
Number of reflections	79620	5817
<I/σ(I)>	0.177
Completeness [%]	100.0
Redundancy	7.5
CC(1/2)	0.991	0.594

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	6% PEG 4000, 5% Glycerol, 0.1 M MES, 30 mM CaCl2, 30 mM MgCl2