5NGV

CRYSTAL STRUCTURE OF THE Activin receptor type-2B LIGAND BINDING DOMAIN IN COMPLEX WITH BIMAGRUMAB FV, ORTHORHOMBIC CRYSTAL FORM

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	CCD
Collection date	2009-12-14
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1.000010
Spacegroup name	I 2 2 2
Unit cell lengths	62.100, 114.170, 117.940
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	17.050 - 2.000
R-factor	0.1779
Rwork	0.177
R-free	0.19820
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2h64
RMSD bond length	0.010
RMSD bond angle	1.030
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER (1.3.1)
Refinement software	BUSTER (2.11.2)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	17.050	17.050	2.050
High resolution limit [Å]	2.000	8.940	2.000
Rmerge	0.070	0.024	0.620
Rmeas	0.080	0.029	0.706
Total number of observations	127273
Number of reflections	28674	370	2072
<I/σ(I)>	14.23	42.36	2.18
Completeness [%]	99.8	98.4	100
Redundancy	4.439	3.776	4.331

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	5.4	293	0.1M PHOSPHATE-CITRATE, 40% PEG 300