8YUA

Tubulin-RB3-TTL in complex with compound SI10

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	2021-12-10
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97915
Spacegroup name	P 21 21 21
Unit cell lengths	105.565, 158.451, 180.669
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	119.130 - 2.370
R-factor	0.2297
Rwork	0.229
R-free	0.25410
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6d88
RMSD bond angle	15.950
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.21_5207: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	119.130	2.490
High resolution limit [Å]	2.370	2.370
Rmerge	0.113	0.802
Rmeas	0.121	0.858
Rpim	0.044	0.302
Total number of observations	930917	139445
Number of reflections	123783	17877
<I/σ(I)>	10.9	2.5
Completeness [%]	99.9
Redundancy	7.5	7.8
CC(1/2)	0.996	0.842

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