Brand  (β version)

color scheme of protein:

hetatm:

x
information
centroid:
interaction residue:

chain:

Ligands
Code Name Link
9MJ 5-amino-3-(furan-2-yl)-1h-1,2,4-triazole-1-carboxamide
IWH 1-(2,4-dimethylbenzyl)-6-oxo-1,6-dihydropyridine-3-carboxamide
Code : 4UCS
Header : LIGASE
Title : Fragment bound to H.influenza NAD dependent DNA ligase
Release Data : 2015-10-14
Compound :
mol_id molecule chains synonym
1 DNA LIGASE A POLYDEOXYRIBONUCLEOTIDE SYNTHASE NAD(+), NAD DEPENDENT DNA LIGASE
ec: 6.5.1.2
fragment: ADENYLATION DOMAIN UNP RESIDUES 1-324
Source :
mol_id organism_scientific expression_system
1 HAEMOPHILUS INFLUENZAE  (taxid:727) ESCHERICHIA COLI  (taxid:562)
Authors : Hale, M., Brassington, C., Carcanague, D., Embrey, K., Eyermann, C.J., Giacobbe, R.A., Gingipali, L., Gowravaram, M., Harang, J., Howard, T., Ioannidis, G., Jahic, H., Kutschke, A., Laganas, V.A., Loch, J., Miller, M.D., Murphy-Benenato, K.E., Oguto, H., Otterbein, L., Patel, S.J., Shapiro, A.B., Boriack-Sjodin, P.A.
Keywords : LIGASE
Exp. method : X-RAY DIFFRACTION ( 1.90 Å )
Citation :

From Fragments to Leads: Novel Bacterial Nad+-Dependent DNA Ligase Inhibitors

Hale, M.,Brassington, C.,Carcanague, D.  et al.
(2015)  Tetrahedron Lett.  56 : 3108

DOI: 10.1016/J.TETLET.2014.12.067

Chain : A
UniProt : P43813 (DNLJ_HAEIN)
Reaction : NAD(+) + (deoxyribonucleotide)(n)-3'-hydroxyl + 5'-phospho-(deoxyribonucleotide)(m) = (deoxyribonucleotide)(n+m) + AMP + beta-nicotinamide D-nucleotide.