6Z3H

Repulsive Guidance Molecule B (RGMB) in complex with Growth Differentiation Factor 5 (GDF5) (crystal form 2)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-09-24
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9795
Spacegroup name	P 62 2 2
Unit cell lengths	98.860, 98.860, 99.810
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	49.430 - 3.158
R-factor	0.2362
Rwork	0.234
R-free	0.26820
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ui0
RMSD bond length	0.001
RMSD bond angle	0.376
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.15rc3_3435: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	64.980	3.210
High resolution limit [Å]	3.130	3.130
Rmerge	0.081
Number of reflections	5352	380
<I/σ(I)>	23.4	1.1
Completeness [%]	97.6
Redundancy	35.8
CC(1/2)		0.806

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		294	0.2 M (NH4)2SO4, 0.1 M sodium acetate pH 4.6, 35% w/v pentaerythritol ethoxylate (15/4 EO/OH; average MW 797 Da)