6CVK

Hepatitis B e-antigen in complex with scFv e13

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2016-03-21
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	46.490, 192.140, 64.980
Unit cell angles	90.00, 98.92, 90.00

Refinement procedure

Resolution	19.785 - 2.380
R-factor	0.1768
Rwork	0.175
R-free	0.22090
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3v6z 2kh2
RMSD bond length	0.012
RMSD bond angle	1.312
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.480
High resolution limit [Å]	2.380	2.380
Rmeas	0.160
Rpim	0.072	0.580
Number of reflections	44849	4459
<I/σ(I)>	10.3	2.4
Completeness [%]	100.0	100
Redundancy	5.1	5.2
CC(1/2)	0.990	0.590

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	289	15% (w/v) PEG 550 MME, 0.1 M MES, pH 6.5