6XMI

Structure of Fab4 bound to P22 TerL(1-33)

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	2020-06-21
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.97
Spacegroup name	P 1 21 1
Unit cell lengths	74.180, 86.395, 86.151
Unit cell angles	90.00, 97.72, 90.00

Refinement procedure

Resolution	14.985 - 1.510
R-factor	0.1677
Rwork	0.167
R-free	0.20320
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6VHM
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.16)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	15.000	1.560
High resolution limit [Å]	1.510	1.510
Rpim	0.042	0.573
Number of reflections	161937	15816
<I/σ(I)>	32.7	1.9
Completeness [%]	96.0	94.3
Redundancy	2.9	2.7
CC(1/2)	0.995	0.456

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	292	0.2 M Succinic acid pH 7.0 and 20% w/v Polyethylene glycol 3,350