Brand  (β version)

PDB ID: 6A84

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Ligands
Code Name Style Show Link
9SU 2-(4-chloro-1,2-dihydro-1'H-spiro[indole-3,4'-piperidin]-1'-yl)-5,6,7,8-tetrahydroquinazolin-4(3h)-one PoSSuM
GOL Glycerol PoSSuM
PO4 Phosphate ion PoSSuM
ZN Zinc ion PoSSuM
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Structure summary

Code : 6A84   PDBj   RCSB PDB   PDBe
Header : TRANSFERASE
Title : Tankyrase-2 in complex with compound 15d
Release Data : 2019-04-03
Compound :
mol_id molecule chains synonym
1 Tankyrase-2 A TANK2,ADP-ribosyltransferase diphtheria toxin-like 6,ARTD6,Poly [ADP-ribose] polymerase 5B,TNKS-2,TRF1-interacting ankyrin-related ADP-ribose polymerase 2,Tankyrase II,Tankyrase-like protein,Tankyrase-related protein
ec: 2.4.2.30
mol_id molecule chains synonym
2 Tankyrase-2 B TANK2,ADP-ribosyltransferase diphtheria toxin-like 6,ARTD6,Poly [ADP-ribose] polymerase 5B,TNKS-2,TRF1-interacting ankyrin-related ADP-ribose polymerase 2,Tankyrase II,Tankyrase-like protein,Tankyrase-related protein
ec: 2.4.2.30
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Escherichia coli  (taxid:562)
gene: TNKS2, PARP5B, TANK2, TNKL
expression_system_vector_type: plasmid
expression_system_plasmid: pCR2.1TOPO
mol_id organism_scientific organism_common expression_system
2 Homo sapiens  (taxid:9606) Human Escherichia coli  (taxid:562)
gene: TNKS2, PARP5B, TANK2, TNKL
expression_system_vector_type: plasmid
expression_system_plasmid: pCR2.1TOPO
Authors : Niwa, H., Shirai, F., Sato, S., Yoshimoto, N., Tsumura, T., Okue, M., Shirouzu, M., Seimiya, H., Umehara, T.
Keywords : Tankyrase, PARP, ADP-ribosylation, Transferase-transferase inhibitor complex, TRANSFERASE
Exp. method : X-RAY DIFFRACTION ( 1.980 Å )
Citation :

Discovery of Novel Spiroindoline Derivatives as Selective Tankyrase Inhibitors.

Shirai, F.,Tsumura, T.,Yashiroda, Y.  et al.
(2019)  J. Med. Chem.  62 : 3407 - 3427

PubMed: 30883102
DOI: 10.1021/acs.jmedchem.8b01888

Reaction

Chain : B
UniProt : Q9H2K2 (TNKS2_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
NAD(+) + (ADP-D-ribosyl)n-acceptor = nicotinamide + (ADP-D- ribosyl)n+1-acceptor + H(+). 2.4.2.30 PubMed:19759537, PubMed:21478859
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L-aspartyl-[protein] + NAD(+) = 4-O-(ADP-D-ribosyl)-L- aspartyl-[protein] + nicotinamide - ECO:0000305
left-to-right
L-glutamyl-[protein] + NAD(+) = 5-O-(ADP-D-ribosyl)-L- glutamyl-[protein] + nicotinamide - ECO:0000305
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