6Y17

Crystal structure of an NCoR1BBD2-BCL6BTB chimera in complex with nebulinSH3-NCoR1BBD1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-05-13
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.96884
Spacegroup name	P 1
Unit cell lengths	39.460, 47.303, 59.781
Unit cell angles	95.86, 95.60, 94.20

Refinement procedure

Resolution	34.920 - 1.560
R-factor	0.1778
Rwork	0.177
R-free	0.20080
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1r28
RMSD bond length	0.008
RMSD bond angle	0.945
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.880	1.600
High resolution limit [Å]	1.560	1.560
Rmerge	0.105	1.157
Rpim	0.105	0.955
Number of reflections	58832	4261
<I/σ(I)>	5.5
Completeness [%]	96.9	95.1
Redundancy	3.4
CC(1/2)	0.989	0.383

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	298	0.66 M ammonium sulfate, 3.3% (v/v) glycerol, 0.05 M magnesium sulfate, 0.1 M imidazole/ hydrochloric acid pH 6.5