6UUP

Structure of anti-hCD33 conditional scFv

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-06-12
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97741
Spacegroup name	P 1 21 1
Unit cell lengths	81.234, 104.635, 87.915
Unit cell angles	90.00, 113.57, 90.00

Refinement procedure

Resolution	46.239 - 2.200
R-factor	0.19790491114
Rwork	0.197
R-free	0.23653
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ouo
RMSD bond length	0.002
RMSD bond angle	0.501
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.300	2.279
High resolution limit [Å]	2.200	2.200
Rmerge	0.192	1.305
Rmeas	0.208	1.410
Rpim	0.079	0.530
Number of reflections	68385	6782
<I/σ(I)>	9.84
Completeness [%]	99.9	99.88
Redundancy	6.9	7
CC(1/2)	0.995	0.634

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1M Tis pH 8.5, 2% Tacsimate pH 8, 16%w/v PEG 3350