5UDD

Crystal Structure of RSV F B9320 Bound to MEDI8897

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2014-11-10
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97924
Spacegroup name	P 32 2 1
Unit cell lengths	229.020, 229.020, 343.250
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.311 - 4.300
R-factor	0.2393
Rwork	0.236
R-free	0.29450
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5ude
RMSD bond length	0.009
RMSD bond angle	0.798
Data reduction software	MOSFLM
Data scaling software	Aimless (0.3.11)
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.311	46.310	4.400
High resolution limit [Å]	4.300	20.620	4.300
Rmerge	0.567	0.079	1.376
Number of reflections	71246
<I/σ(I)>	3.7
Completeness [%]	99.9	90	100
Redundancy	7.2	5.3	7.5
CC(1/2)	0.971	0.997	0.627

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	293	0.1 M Tris pH 8.0, 1.4 M ammonium sulfate, 0.2 M sodium thiocyanate