Het-PDB Navi2 (PDB: 4EI4)

The number of atoms exceeds 100,000.
So, it can not be displayed here.

Select unit:

Select hetatm:

information

centroid:

interaction residue:

Select chain: Sequence Hide other chain(s)

Data format:

Color scheme of protein:

Ligands
Code	Name		Style	Show	Link
0Q2	(1r,3r)-3-(2-methylimidazo[4,5-D]pyrrolo[2,3-B]pyridin-1(8h)-yl)cyclohexanol				PoSSuM

Non-standard Residues
Code	Name	Show
PTR	O-phosphotyrosine

Glycosylation
Code	Name	Emphasize

Modification
Code	Name	Show

Download interaction data: 4EI4

Code :

4EI4 PDBj RCSB PDB PDBe

Header :

TRANSFERASE/TRANSFERASE INHIBITOR

Title :

JAK1 kinase (JH1 domain) in complex with compound 20

Release Data :

2012-07-04

Compound :

mol_id	molecule	chains	synonym
1	Tyrosine-protein kinase JAK1	A,B	Janus kinase 1, JAK-1
	ec: 2.7.10.2 fragment: JH1 (kinase) domain (unp residues 854-1154)

Source :

mol_id	organism_scientific	organism_common	expression_system
1	Homo sapiens (taxid:9606)	Human	Spodoptera frugiperda (taxid:7108)
	gene: JAK1, JAK1A, JAK1B

Authors :

Eigenbrot, C., Steffek, M.

Keywords :

protein kinase, phospho-transfer catalyst, TRANSFERASE-TRANSFERASE INHIBITOR complex

Exp. method :

X-RAY DIFFRACTION ( 2.22 Å )

Citation :

Discovery and optimization of C-2 methyl imidazopyrrolopyridines as potent and orally bioavailable JAK1 inhibitors with selectivity over JAK2.

Zak, M.,Mendonca, R.,Balazs, M. et al.
(2012) J.Med.Chem. 55 : 6176 - 6193

Chain :

A, B

UniProt :

P23458 (JAK1_HUMAN)

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:1848670, PubMed:7615558
	-	PROSITE-ProRule:PRU10028, PubMed:1848670, PubMed:7615558

PDB ID: 4EI4