4R3S

Crystal Structure of anti-MSP2 Fv fragment (mAb6D8)in complex with MSP2 11-23

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	100
Detector technology	CCD
Collection date	2014-05-09
Detector	ADSC QUANTUM 210r
Wavelength(s)	0.9537
Spacegroup name	P 21 21 21
Unit cell lengths	35.210, 64.340, 89.870
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	52.315 - 1.700
R-factor	0.1543
Rwork	0.152
R-free	0.20040
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4qyo
RMSD bond length	0.017
RMSD bond angle	1.607
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8.4_1496))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	52.315	1.761
High resolution limit [Å]	1.700	1.700
Rmerge	0.882	2.010
Number of reflections	23184
<I/σ(I)>		5.15
Completeness [%]	100.0	100
Redundancy	33.8	32.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4	293	30% PEG 8000, 0.2M NACL, 0.1M NAOAC, pH 4.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K