7UGI

Bromodomain of EP300 liganded with BMS-536924

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Temperature [K]	93
Detector technology	CCD
Collection date	2020-03-16
Detector	RIGAKU SATURN 944+
Wavelength(s)	1.54178
Spacegroup name	P 31 2 1
Unit cell lengths	43.230, 43.230, 270.890
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.148 - 2.000
R-factor	0.2189
Rwork	0.216
R-free	0.27440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5bt3
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.150	2.050
High resolution limit [Å]	2.000	2.000
Rmeas	0.108	0.807
Number of reflections	20775	1522
<I/σ(I)>	8	1.5
Completeness [%]	98.5
Redundancy	3.6	2.9
CC(1/2)	0.995	0.628

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	292	0.05M Potassium phosphate monobasic 20% w/v Polyethylene glycol 8,000