7OLW

Structure of the N-terminal domain of BC2L-C lectin (1-131) in complex with a synthetic beta-N-fucoside ligand

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-02-05
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.979
Spacegroup name	P 63
Unit cell lengths	42.931, 42.931, 94.882
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	37.179 - 1.320
Rwork	0.103
R-free	0.12930
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2wq4
RMSD bond length	0.012
RMSD bond angle	1.594
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.440	1.340
High resolution limit [Å]	1.320	1.320
Rmerge	0.054	0.480
Rmeas	0.057	0.505
Rpim	0.018	0.158
Number of reflections	23283	1150
<I/σ(I)>	30.6	6.7
Completeness [%]	100.0	100
Redundancy	20.2	20.1
CC(1/2)	1.000	0.959

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	292	sodium citrate 1.2M