8XV9

Fedratinib-bound human SLC19A3

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Soluble cytochrome b562,Thiamine transporter 2	polymer	607	67910.0	1	UniProt (P0ABE7) UniProt (Q9BZV2) Pfam (PF01770)	Escherichia coli	Cytochrome b-562,ThTr-2,ThTr2,Solute carrier family 19 member 3
2	B (A)	N-tert-butyl-3-{[5-methyl-2-({4-[2-(pyrrolidin-1-yl)ethoxy]phenyl}amino)pyrimidin-4-yl]amino}benzenesulfonamide	non-polymer		524.7	1	Chemie (2TA) PubChem (16722836)

Sequence modifications

A: -95 - 10 (UniProt: P0ABE7)

PDB	External Database	Details
Leu -107	-	expression tag
Glu -106	-	expression tag
Val -105	-	expression tag
Leu -104	-	expression tag
Phe -103	-	expression tag
Gln -102	-	expression tag
Gly -101	-	expression tag
Pro -100	-	expression tag
Ser -99	-	expression tag
Arg -98	-	expression tag
Ala -97	-	expression tag
Thr -96	-	expression tag
Trp -89	Met 29	conflict
Ile 6	His 124	conflict
Leu 10	Arg 128	conflict

A: 11 - 496 (UniProt: Q9BZV2)

PDB	External Database	Details
Ser 497	-	expression tag
Asn 498	-	expression tag
Ser 499	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	67910.0
Non-Polymers*	Number of molecules	1
	Total formula weight	524.7
All*	Total formula weight	68434.7

*Water molecules are not included.