Het-PDB Navi2 (PDB: 3UXM)

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Ligands
Code	Name		Style	Show	Link
MG	Magnesium ion				PoSSuM
0DN	5'-deoxy-5'-fluorothymidine				PoSSuM

Non-standard Residues
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Download interaction data: 3UXM

Code :

3UXM PDBj RCSB PDB PDBe

Header :

TRANSFERASE/TRANSFERASE INHIBITOR

Title :

Structure Guided Development of Novel Thymidine Mimetics targeting Pseudomonas aeruginosa Thymidylate Kinase: from Hit to Lead Generation

Release Data :

2012-02-01

Compound :

mol_id	molecule	chains	synonym
1	Thymidylate kinase	A,B,C,D	dTMP kinase
	ec: 2.7.4.9 fragment: Kinase domain

Source :

mol_id	organism_scientific	expression_system
1	Pseudomonas aeruginosa (taxid:208964)	Escherichia coli (taxid:469008)
	strain: ATCC 15692 / PAO1 / 1C / PRS 101 / LMG 12228 gene: PA2962, tmk expression_system_strain: BL21 DE3 expression_system_vector_type: plasmid expression_system_plasmid: pET15b

Authors :

Choi, J.Y., Plummer, M.S., Starr, J., Desbonnet, C.R., Soutter, H.H., Chang, J., Miller, J.R., Dillman, K., Miller, A.A., Roush, W.R.

Keywords :

Thymidylate kinase, thymidine triphosphate, TRANSFERASE-TRANSFERASE INHIBITOR complex

Exp. method :

X-RAY DIFFRACTION ( 1.95 Å )

Citation :

Structure guided development of novel thymidine mimetics targeting Pseudomonas aeruginosa thymidylate kinase: from hit to lead generation.

Choi, J.Y.,Plummer, M.S.,Starr, J. et al.
(2012) J.Med.Chem. 55 : 852 - 870

Chain :

A, B, C, D

UniProt :

Q9HZN8 (KTHY_PSEAE)

PDB ID: 3UXM