9SI2

Human DDR1 in complex with a pyrrolidine 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)	Epithelial discoidin domain-containing receptor 1	polymer	310	35182.4	1	UniProt (Q08345) Pfam (PF07714)	Homo sapiens (human)	Epithelial discoidin domain receptor 1,CD167 antigen-like family member A,Cell adhesion kinase,Discoidin receptor tyrosine kinase,HGK2,Mammary carcinoma kinase 10,MCK-10,Protein-tyrosine kinase 3A,Protein-tyrosine kinase RTK-6,TRK E,Tyrosine kinase DDR,Tyrosine-protein kinase CAK
2	B (A)	~{N}-methyl-5-[(3~{S})-3-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]pyrrolidin-1-yl]pyridine-3-carboxamide	non-polymer		482.5	1	Chemie (A1JN1)
3	C (A)	CHLORIDE ION	non-polymer		35.5	1	Chemie (CL) PubChem (312)
4	D (A)	2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL	non-polymer		282.3	1	Chemie (B3P) PubChem (125132)
5	E (A)	water	water		18.0	177	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	35182.4
Non-Polymers*	Number of molecules	3
	Total formula weight	800.3
All*	Total formula weight	35982.7

*Water molecules are not included.