6PSC

Antibody scFv-M204 trimeric state

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-06-22
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.97910
Spacegroup name	P 43 2 2
Unit cell lengths	60.160, 60.160, 526.380
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	65.800 - 3.600
R-factor	0.2545
Rwork	0.252
R-free	0.28210
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6pk8
RMSD bond length	0.008
RMSD bond angle	1.496
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC (5.8.0253)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	65.800	65.800	3.690
High resolution limit [Å]	3.600	16.100	3.600
Rmerge	0.240	0.069	0.923
Rmeas	0.303	0.084	1.172
Total number of observations	24601
Number of reflections	10789	119	795
<I/σ(I)>	3.69	9.46	0.93
Completeness [%]	87.4	61	91.1
Redundancy	2.28	1.933	2.22
CC(1/2)	0.953	0.994	0.458

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5	298	1.5 M Ammonium sulfate, 0.1 M sodium acetate pH 5.0