5MQG

Crystal structure of CREBBP bromodomain complexed with CBP015

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-09-26
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.99998
Spacegroup name	H 3
Unit cell lengths	121.436, 121.436, 40.271
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	37.608 - 1.350
R-factor	0.1719
Rwork	0.171
R-free	0.19120
RMSD bond length	0.006
RMSD bond angle	0.891
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall
Low resolution limit [Å]	37.610
High resolution limit [Å]	1.350
Rmerge	0.030
Number of reflections	48059
<I/σ(I)>	20.7
Completeness [%]	98.8
Redundancy	4.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.2 M potassium thiocyanate, 0.1 M Bis-Tris, pH 5.5, 5% v/v ethylene glycol, 23% PEG3350