7BHF

DARPin_D5/Her3 domain 4 complex, orthorhombic crystals

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	2017-05-28
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.000
Spacegroup name	P 21 21 21
Unit cell lengths	62.258, 64.951, 144.895
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.190 - 1.997
R-factor	0.2003
Rwork	0.198
R-free	0.24320
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7bhe
RMSD bond length	0.008
RMSD bond angle	0.970
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	BUSTER (2.10.3 (18-SEP-2020))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.192	2.031
High resolution limit [Å]	1.997	1.997
Rmerge	0.216	1.657
Rmeas	0.230	1.776
Rpim	0.075	0.610
Number of reflections	38572	1904
<I/σ(I)>	7.4
Completeness [%]	94.7	96.5
Redundancy	8.87	8.2
CC(1/2)	0.991	0.387

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	4.74	293	0.1 M Na citrate, 10% PEG4000, 0.2 M Li sulfate