7O4Y

m971 Fab in complex with anti-Kappa VHH domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-07-13
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.979510
Spacegroup name	P 31
Unit cell lengths	73.998, 73.998, 98.808
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	39.127 - 1.600
R-factor	0.2198
Rwork	0.219
R-free	0.24590
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6ani
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	39.127	39.127	1.700
High resolution limit [Å]	1.600	4.760	1.600
Rmerge	0.045	0.027	0.537
Rmeas	0.051	0.031	0.620
Total number of observations	329897
Number of reflections	79907	3004	12852
<I/σ(I)>	17.31	50.92	2.36
Completeness [%]	99.8	99.7	99.4
Redundancy	4.129	4.23	3.969
CC(1/2)	0.999	0.998	0.777

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.2M lithium acetate, 20% PEG 3350