Brand  (β version)

PDB ID: 5W5O

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Ligands
Code Name Style Show Link
9XA 4-{6-(tert-butylsulfonyl)-7-[2-(4-methylpiperazin-1-yl)ethoxy]imidazo[1,2-a]pyridin-3-yl}-6-chloropyridin-2-amine PoSSuM
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Structure summary

Code : 5W5O   PDBj   RCSB PDB   PDBe
Header : Transferase/Transferase Inhibitor
Title : Identification of potent and selective RIPK2 inhibitors for the treatment of inflammatory diseases.
Release Data : 2017-10-25
Compound :
mol_id molecule chains synonym
1 Receptor-interacting serine/threonine-protein kinase 2 A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P CARD-containing interleukin-1 beta-converting enzyme-associated kinase,CARD-containing IL-1 beta ICE-kinase,RIP-like-interacting CLARP kinase,Receptor-interacting protein 2,RIP-2,Tyrosine-protein kinase RIPK2
ec: 2.7.11.1,2.7.10.2
fragment: UNP residues 2-311
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Unidentified baculovirus  (taxid:10469)
gene: RIPK2, CARDIAK, RICK, RIP2, UNQ277/PRO314/PRO34092
expression_system_strain: sf9
Authors : Kreusch, A., Spraggon, G.
Keywords : Inhibitor, Kinase, Tetartohedral winning, Transferase-Transferase Inhibitor complex
Exp. method : X-RAY DIFFRACTION ( 2.89 Å )
Citation :

Identification of Potent and Selective RIPK2 Inhibitors for the Treatment of Inflammatory Diseases.

He, X.,Da Ros, S.,Nelson, J.  et al.
(2017)  ACS Med Chem Lett  8 : 1048 - 1053

PubMed: 29057049
DOI: 10.1021/acsmedchemlett.7b00258

Reaction

Chain : A, B, C, D, E, F, G, H, I, J, K, L, M, N, O, P
UniProt : O43353 (RIPK2_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
ATP + L-seryl-[protein] = ADP + H(+) + O-phospho-L-seryl- [protein] 2.7.11.1 PubMed:16824733
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ATP + L-threonyl-[protein] = ADP + H(+) + O-phospho-L- threonyl-[protein] 2.7.11.1 -
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ATP + L-tyrosyl-[protein] = ADP + H(+) + O-phospho-L-tyrosyl- [protein] 2.7.10.2 PROSITE-ProRule:PRU10027, PubMed:21123652
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