Het-PDB Navi2 (PDB: 3SMJ)

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Ligands
Code	Name		Style	Show	Link
FDR	2-methyl-3,5,6,7-tetrahydro-4h-cyclopenta[4,5]thieno[2,3-D]pyrimidin-4-one				PoSSuM
GOL	Glycerol				PoSSuM

Non-standard Residues
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Download interaction data: 3SMJ

Code :

3SMJ PDBj RCSB PDB PDBe

Header :

TRANSFERASE/TRANSFERASE Inhibitor

Title :

Human poly(ADP-ribose) polymerase 14 (Parp14/Artd8) - catalytic domain in complex with a pyrimidine-like inhibitor

Release Data :

2011-07-20

Compound :

mol_id	molecule	chains	synonym
1	Poly [ADP-ribose] polymerase 14	A,B	PARP-14, B aggressive lymphoma protein 2
	ec: 2.4.2.30 fragment: Catalytic domain

Source :

mol_id	organism_scientific	organism_common	expression_system
1	Homo sapiens (taxid:9606)	Human	Escherichia coli (taxid:469008)
	gene: BAL2, KIAA1268, PARP14 expression_system_strain: BL21(DE3) R3 pRARE expression_system_vector_type: PLASMID expression_system_plasmid: pNIC-Bsa4

Authors :

Karlberg, T., Moche, M., Arrowsmith, C.H., Berglund, H., Bountra, C., Edwards, A.M., Ekblad, T., Graslund, S., Kouznetsova, E., Nordlund, P., Nyman, T., Thorsell, A.G., Tresaugues, L., Weigelt, J., Schuler, H., Structural Genomics Consortium (SGC)

Keywords :

DIPHTHERIA TOXIN LIKE FOLD, TRANSFERASE, NAD+, ADP-RIBOSYLATION, TRANSFERASE-TRANSFERASE Inhibitor complex, Structural Genomics, Structural Genomics Consortium, SGC

Exp. method :

X-RAY DIFFRACTION ( 1.50 Å )

Citation :

Family-wide chemical profiling and structural analysis of PARP and tankyrase inhibitors.

Wahlberg, E.,Karlberg, T.,Kouznetsova, E. et al.
(2012) Nat.Biotechnol. 30 : 283 - 288

PubMed: 22343925
DOI: 10.1038/nbt.2121

Chain :

A, B

UniProt :

Q460N5 (PAR14_HUMAN)

Reaction:	EC:	Evidence:
Reaction:	Physiological Direction:	Evidence:
L-glutamyl-[protein] + NAD(+) = 5-O-(ADP-D-ribosyl)-L- glutamyl-[protein] + nicotinamide	-	PubMed:27796300
	left-to-right	PubMed:27796300

PDB ID: 3SMJ

Hetero Atom Contents

Structure summary

Reaction