6G8R

SP140 PHD-Bromodomain complex with scFv

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	2017-10-17
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.96861
Spacegroup name	P 61 2 2
Unit cell lengths	89.200, 89.200, 343.350
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	64.110 - 2.740
R-factor	0.2169
Rwork	0.215
R-free	0.24920
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2md8 5fbo 5gs3
RMSD bond length	0.004
RMSD bond angle	1.301
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	REFMAC (5.8.0257)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	64.110	64.110	2.810
High resolution limit [Å]	2.740	12.250	2.740
Rmerge	0.225	0.037	3.230
Rmeas	0.237	0.039	3.394
Total number of observations	422035
Number of reflections	22312	471	2983
<I/σ(I)>	8.93	40.46	0.72
Completeness [%]	99.5	98.1	99.7
Redundancy	10.531	10.038	10.594
CC(1/2)	0.997	0.999	0.442

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	1.2 M sodium malonate, 0.5 % jeffamine ED-2003, 0.1 M HEPES pH 7.0