1F81

SOLUTION STRUCTURE OF THE TAZ2 DOMAIN OF THE TRANSCRIPTIONAL ADAPTOR PROTEIN CBP

SOLUTION NMR

NMR Experiment
Experiment	Type	Sample Contents	Solvent	Ionic Strength	pH	Pressure	Temperature (K)	Spectrometer
1	3D_13C-separated_NOESY	1.5 mM Taz2	25 mM deuterated acetate 0.1 mM ZnCl2 0.1 mM DTT pH 5.9	25 mM	5.9	1 atm	298
2	3D_15N-separated_NOESY	1.5 mM Taz2	25 mM deuterated acetate 0.1 mM ZnCl2 0.1 mM DTT pH 5.9	25 mM	5.9	1 atm	298
3	4D_13C-separated_NOESY	1.5 mM Taz2	25 mM deuterated acetate 0.1 mM ZnCl2 0.1 mM DTT pH 5.9	25 mM	5.9	1 atm	298
4	HNCA-J	1.5 mM Taz2	25 mM deuterated acetate 0.1 mM ZnCl2 0.1 mM DTT pH 5.9	25 mM	5.9	1 atm	298
5	HNHA	1.5 mM Taz2	25 mM deuterated acetate 0.1 mM ZnCl2 0.1 mM DTT pH 5.9	25 mM	5.9	1 atm	298
6	CBCA(CO)HN	1.5 mM Taz2	25 mM deuterated acetate 0.1 mM ZnCl2 0.1 mM DTT pH 5.9	25 mM	5.9	1 atm	298

NMR Spectrometer Information
Spectrometer	Manufacturer	Model	Field Strength
1	Bruker	DMX	600
2	Bruker	AMX	500
3	Bruker	DRX	750

NMR Refinement
Method	Details	Software
distance geometry simulated annealing molecular dynamics matrix relaxation torsion angle dynamics		DYANA

NMR Ensemble Information
Conformer Selection Criteria	structures with acceptable covalent geometry,structures with favorable non-bond energy,structures with the least restraint violations,structures with the lowest energy,target function
Conformers Calculated Total Number	50
Conformers Submitted Total Number	20
Representative Model	20 (fewest violations,lowest energy)

Computation: NMR Software
#	Classification	Version	Software Name	Author
1	structure solution	DYANA	1.5	Peter Guntert
2	structure solution	Amber	6	Case, Pearlman,
3	processing	NMRPipe	4	Delaglio, Bax
4	refinement	Amber	6	Case, Pearlman,

RCSB PDB Core Operations are funded by the National Science Foundation (DBI-1832184), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM133198.