5GRW

Crystal structure of homo-specific diabody

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	80
Detector technology	CCD
Collection date	2013-04-11
Detector	ADSC QUANTUM 270
Wavelength(s)	0.97934
Spacegroup name	C 1 2 1
Unit cell lengths	120.487, 130.028, 38.345
Unit cell angles	90.00, 101.89, 90.00

Refinement procedure

Resolution	37.620 - 2.800
R-factor	0.1819
Rwork	0.182
R-free	0.18220
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5gs1
RMSD bond length	0.008
RMSD bond angle	1.084
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]	50.000	2.900
High resolution limit [Å]	2.800	2.800
Number of reflections	16796
<I/σ(I)>	10.5
Completeness [%]	98.6
Redundancy	3.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.5	296	0.1 M Sodium citrate pH 4.5, 0.3 M Ammonium acetate, 30% PEG 4000