3DCQ

LECB (PA-LII) in complex with the synthetic ligand 2G0

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, C, D (A, B, C, D)	Fucose-binding lectin PA-IIL	polymer	114	11734.7	4	UniProt (Q9HYN5) Pfam (PF07472)	Pseudomonas aeruginosa
2	E, F, H, I, K... (A, B, C, D)	CALCIUM ION	non-polymer		40.1	8	Chemie (CA)
3	G, J, M, P (A, B, C, D)	(2S)-1-[(2S)-6-amino-2-({[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl]acetyl}amino)hexanoyl]-N-[(1S)-1-carbamoyl-3-methylbutyl]pyrrolidine-2-carboxamide	non-polymer		543.7	4	Chemie (2G0)
4	Q, R, S, T (A, B, C, D)	water	water		18.0	340	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	46938.8
Non-Polymers*	Number of molecules	12
	Total formula weight	2495.2
All*	Total formula weight	49434.1

*Water molecules are not included.