9RR6

Galectin-3 with a bound inhibitor

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Galectin-3	polymer	138	15701.0	1	UniProt (P17931) Pfam (PF00337)	Homo sapiens (human)	Gal-3,35 kDa lectin,Carbohydrate-binding protein 35,CBP 35,Galactose-specific lectin 3,Galactoside-binding protein,GALBP,IgE-binding protein,L-31,Laminin-binding protein,Lectin L-29,Mac-2 antigen
2	B (A)	DIMETHYL SULFOXIDE	non-polymer		78.1	1	Chemie (DMS) PubChem (679)
3	C (A)	(2~{S})-2-[4,4-bis(fluoranyl)-1-oxidanyl-cyclohexyl]-2-[(2~{S},3~{R},4~{S},5~{R},6~{R})-6-(hydroxymethyl)-3-methoxy-5-oxidanyl-4-[4-[3,4,5-tris(fluoranyl)phenyl]-1,2,3-triazol-1-yl]oxan-2-yl]sulfanyl-~{N}-methyl-~{N}-pyridin-2-yl-ethanamide	non-polymer		673.7	1	Chemie (A1JIR)
4	D (A)	THIOCYANATE ION	non-polymer		58.1	1	Chemie (SCN) PubChem (9322)
5	E (A)	water	water		18.0	207	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	15701.0
Non-Polymers*	Number of molecules	3
	Total formula weight	809.9
All*	Total formula weight	16510.9

*Water molecules are not included.