6FIQ

DDR1, 1-(1H-indazole-5-carbonyl)-5'-methoxy-1'-[2-oxo-2-[(2S)-2-(trifluoromethyl)pyrrolidin-1-yl]ethyl]spiro[piperidine-4,3'-pyrrolo[3,2-b]pyridine]-2'-one, 1.790A, P212121, Rfree=23.8%

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Epithelial discoidin domain-containing receptor 1	polymer	321	36502.9	1	UniProt (Q08345) Pfam (PF07714) In PDB	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	A	1-(1~{H}-indazol-5-ylcarbonyl)-5'-methoxy-1'-[2-oxidanylidene-2-[(2~{S})-2-(trifluoromethyl)pyrrolidin-1-yl]ethyl]spiro[piperidine-4,3'-pyrrolo[3,2-b]pyridine]-2'-one	non-polymer		556.5	1	Chemie (DJW)
3	A	CHLORIDE ION	non-polymer		35.5	1	Chemie (CL)
4		water	water		18.0	150	Chemie (HOH)

Sequence modifications

A: 593 - 907 (UniProt: Q08345)

PDB	External Database	Details
-	Gly 730	deletion
-	Gln 731	deletion
-	Ala 732	deletion
-	Ala 733	deletion
-	Gln 734	deletion
-	Gly 735	deletion
His 908	-	expression tag
His 909	-	expression tag
His 910	-	expression tag
His 911	-	expression tag
His 912	-	expression tag
His 913	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	36502.9
Non-Polymers*	Number of molecules	2
	Total formula weight	592.0
All*	Total formula weight	37094.8

*Water molecules are not included.