5I4F

scFv 2D10 complexed with alpha 1,6 mannobiose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE BM14
Synchrotron site	ESRF
Beamline	BM14
Temperature [K]	173.15
Detector technology	CCD
Collection date	2014-02-20
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.97856
Spacegroup name	P 31 2 1
Unit cell lengths	81.093, 81.093, 74.388
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	35.114 - 1.549
R-factor	0.1697
Rwork	0.167
R-free	0.19310
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4h0g
RMSD bond length	0.010
RMSD bond angle	1.593
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX (1.8.2_1309)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.610
High resolution limit [Å]	1.549	1.549
Rmerge	0.046	0.506
Number of reflections	41534
<I/σ(I)>	39.67	2.9
Completeness [%]	99.4	99.2
Redundancy	5.5	5.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	277.15	MES 6.5, Magnesium sulphate (1.5 M), potassium sodium tartrate tetrahydrate (0.1M).