Het-PDB Navi2 (PDB: 6HD6)

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Ligands
Code	Name	Link
CL	Chloride ion	PoSSuM
FYH	3-(morpholin-4-ylmethyl)-~{N}-[4-(trifluoromethyloxy)phenyl]benzamide	PoSSuM
STI	4-(4-methyl-piperazin-1-ylmethyl)-N-[4-methyl-3-(4-pyridin-3-yl-pyrimidin-2-ylamino)-phenyl]-benzamide	PoSSuM

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Download interaction data: 6HD6

Code :

6HD6 PDBj RCSB PDB PDBe

Header :

TRANSFERASE

Title :

ABL1 IN COMPLEX WITH COMPOUND6 AND IMATINIB (STI-571)

Release Data :

2018-09-12

Compound :

mol_id	molecule	chains	synonym
1	Tyrosine-protein kinase ABL1	A,B	Abelson murine leukemia viral oncogene homolog 1,Abelson tyrosine-protein kinase 1,Proto-oncogene c-Abl,p150
	ec: 2.7.10.2 fragment: KINASE DOMAIN

Source :

mol_id	organism_scientific	organism_common	expression_system
1	Mus musculus (taxid:10090)	House Mouse	Spodoptera frugiperda (taxid:7108)
	gene: Abl1, Abl expression_system_common: Fall armyworm expression_system_variant: SF9

Authors :

Cowan-Jacob, S.W.

Keywords :

PHOSPHOTRANSFERASE, Inhibitor complex, TRANSFERASE

Exp. method :

X-RAY DIFFRACTION ( 2.30 Å )

Citation :

Discovery of Asciminib (ABL001), an Allosteric Inhibitor of the Tyrosine Kinase Activity of BCR-ABL1.

Schoepfer, J.,Jahnke, W.,Berellini, G. et al.
(2018) J. Med. Chem. 61 : 8120 - 8135

Chain :

A, B

UniProt :

P00520 (ABL1_MOUSE)

Reaction:	EC:	Evidence:
Reaction:	Physiological Direction:	Evidence:
ATP + L-tyrosyl-[protein] = ADP + H(+) + O-phospho-L-tyrosyl- [protein]	2.7.10.2	PROSITE-ProRule:PRU10028, PubMed:10988075, PubMed:12748290, PubMed:19878872, PubMed:20072125
	-

PDB ID: 6HD6