7KDZ

Crystal structure of the bromodomain (BD) of human Bromodomain and PHD finger-containing Transcription Factor (BPTF) bound to TP-238

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-01-31
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1
Spacegroup name	P 43 21 2
Unit cell lengths	42.670, 42.670, 126.820
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	31.710 - 1.540
R-factor	0.1865
Rwork	0.185
R-free	0.20510
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3uv2
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	31.710	31.710	1.580
High resolution limit [Å]	1.540	6.890	1.540
Rmerge	0.074	0.041	0.925
Rmeas	0.077	0.043	0.961
Total number of observations	255441
Number of reflections	18158	261	1314
<I/σ(I)>	18.45	41.88	3.13
Completeness [%]	99.8	99.6	99.9
Redundancy	14.068	11.456	13.846
CC(1/2)	0.999	0.999	0.883

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		290	0.2M Lithium sulfate monohydrate, 0.1M BIS-TRIS pH6.5, 25 percent polyethylene glycol 3,350