Het-PDB Navi2 (PDB: 4D9U)

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Ligands
Code	Name		Style	Show	Link
0JH	Tert-butyl (2s)-3-[4-amino-7-(3-hydroxypropyl)-5-(4-methylphenyl)-7h-pyrrolo[2,3-D]pyrimidin-6-yl]-2-cyanopropanoate				PoSSuM
NA	Sodium ion				PoSSuM

Non-standard Residues
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Glycosylation
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Download interaction data: 4D9U

Code :

4D9U PDBj RCSB PDB PDBe

Header :

TRANSFERASE/TRANSFERASE INHIBITOR

Title :

Rsk2 C-terminal Kinase Domain, (E)-tert-butyl 3-(4-amino-7-(3-hydroxypropyl)-5-P-tolyl-7H-pyrrolo[2,3-D]pyrimidin-6-yl)-2-cyanoacrylate

Release Data :

2012-04-11

Compound :

mol_id	molecule	chains	synonym
1	Ribosomal protein S6 kinase alpha-3	A	S6K-alpha-3, 90 kDa ribosomal protein S6 kinase 3, p90-RSK 3, p90RSK3, Insulin-stimulated protein kinase 1, ISPK-1, MAP kinase-activated protein kinase 1b, MAPK-activated protein kinase 1b, MAPKAP kinase 1b, MAPKAPK-1b, Ribosomal S6 kinase 2, RSK-2, pp90RSK2
	ec: 2.7.11.1 fragment: UNP residues 399-740

Source :

mol_id	organism_scientific	organism_common	expression_system
1	Homo sapiens (taxid:9606)	Human	Escherichia coli (taxid:469008)
	gene: ISPK1, MAPKAPK1B, RPS6KA3, RSK2 expression_system_strain: BL21(DE3) expression_system_vector_type: plasmid expression_system_plasmid: pET46

Authors :

Serafimova, I.M., Pufall, M.A., Krishnan, S., Duda, K., Cohen, M.S., Maglathlin, R.L., McFarland, J.M., Miller, R.M., Frodin, M., Taunton, J.

Keywords :

kinase, reversible inhibitor, phosphorylation, TRANSFERASE-TRANSFERASE INHIBITOR complex

Exp. method :

X-RAY DIFFRACTION ( 2.4000 Å )

Citation :

Reversible targeting of noncatalytic cysteines with chemically tuned electrophiles.

Serafimova, I.M.,Pufall, M.A.,Krishnan, S. et al.
(2012) Nat.Chem.Biol. 8 : 471 - 476

Chain :

UniProt :

P51812 (KS6A3_HUMAN)

Reaction:	EC:	Evidence:
Reaction:	Physiological Direction:	Evidence:
ATP + L-seryl-[protein] = ADP + H(+) + O-phospho-L-seryl- [protein]	2.7.11.1	PubMed:17213202
	-	PubMed:17213202
ATP + L-threonyl-[protein] = ADP + H(+) + O-phospho-L- threonyl-[protein]	2.7.11.1	-
	-	-

PDB ID: 4D9U