5GS1

Crystal structure of homo-specific diabody

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2012-04-20
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97949
Spacegroup name	P 21 21 21
Unit cell lengths	114.123, 128.807, 259.835
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.046 - 2.000
R-factor	0.267
Rwork	0.267
R-free	0.28590
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2v7n
RMSD bond length	0.002
RMSD bond angle	0.617
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.070
High resolution limit [Å]	2.000	2.000
Number of reflections	248167
<I/σ(I)>	18.6
Completeness [%]	96.6
Redundancy	5.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.6	296	0.1 M Sodium citrate pH 4.6, 0.2 M Ammonium sulfate, 18% PEG 8000