8FIF

A2.3 Nanobody In Complex With Microcystin-LR

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-01-26
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979460
Spacegroup name	P 21 21 21
Unit cell lengths	38.097, 101.317, 102.412
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.685 - 2.350
Rwork	0.236
R-free	0.28010
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.920
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0403)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.010	2.430
High resolution limit [Å]	2.350	2.350
Rmerge	0.067	0.997
Rmeas	0.082
Rpim	0.046	0.680
Number of reflections	17031	1635
<I/σ(I)>	12.9
Completeness [%]	99.1
Redundancy	5.4
CC(1/2)	0.998

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	25% w/v PEG MME 3350, 200 mM ammonium sulfate, 100 mM HEPES