6B0S

Crystal structure of circumsporozoite protein aTSR domain in complex with 1710 antibody

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	CCD
Collection date	2016-07-14
Detector	RAYONIX MX300HE
Wavelength(s)	0.97948
Spacegroup name	P 21 21 21
Unit cell lengths	70.487, 70.683, 96.283
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.789 - 1.950
R-factor	0.1826
Rwork	0.180
R-free	0.22380
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1710 Fab 3vdj
RMSD bond length	0.003
RMSD bond angle	0.653
Data reduction software	XDS
Data scaling software	XPREP
Phasing software	PHENIX
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	2.050
High resolution limit [Å]	1.950	1.950
Rpim	0.062	0.295
Number of reflections	35815	4909
<I/σ(I)>	11.6	1.7
Completeness [%]	100.0	100
Redundancy	7.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		294	200 mM MgCl2, 20% (w/v) PEG 3350