6PBW

Crystal structure of Fab667 complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-05-15
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9795
Spacegroup name	P 32 2 1
Unit cell lengths	70.397, 70.397, 186.485
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	43.526 - 2.058
R-factor	0.2046
Rwork	0.202
R-free	0.25840
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	homology model
RMSD bond length	0.002
RMSD bond angle	0.524
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX ((1.16_3549: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.090
High resolution limit [Å]	2.050	2.050
Rpim	0.054	0.432
Number of reflections	32790	1304
<I/σ(I)>	12	1.1
Completeness [%]	97.7	78.8
Redundancy	9.8
CC(1/2)	0.907	0.706

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	20% glycerol 25% PEG1500