Brand  (β version)

PDB ID: 3BZ0

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Ligands
Code Name Style Show Link
C00 2-(4-hydroxybiphenyl-3-yl)-4-methyl-1h-isoindole-1,3(2h)-dione PoSSuM
UMP 2'-deoxyuridine 5'-monophosphate PoSSuM
Non-standard Residues
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Glycosylation
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Structure summary

Code : 3BZ0   PDBj   RCSB PDB   PDBe
Header : TRANSFERASE
Title : Lactobacillus Casei Thymidylate Synthase Ternary Complex with DUMP and the Phtalimidic Derivative C00
Release Data : 2009-01-20
Compound :
mol_id molecule chains synonym
1 Thymidylate synthase A TS, TSase
ec: 2.1.1.45
Source :
mol_id organism_scientific expression_system
1 Lactobacillus casei  (taxid:1582) Escherichia coli  (taxid:562)
expression_system_strain: Chi 2913
expression_system_vector_type: plasmid
expression_system_plasmid: PKPTSD
Authors : Leone, R., Cancian, L., Costi, M.P., Ferrari, S., Luciani, R., Mangani, S.
Keywords : NUCLEOTIDE SYNTHASE, STRUCTURE BASED DRUG DESIGN, Methyltransferase, Nucleotide biosynthesis, Transferase
Exp. method : X-RAY DIFFRACTION ( 2.70 Å )
Citation :

Identification of the binding modes of N-phenylphthalimides inhibiting bacterial thymidylate synthase through X-ray crystallography screening

Mangani, S.,Cancian, L.,Leone, R.  et al.
(2011)  J.Med.Chem.  54 : 5454 - 5467

PubMed: 21696158
DOI: 10.1021/jm2005018

Reaction

Chain : A
UniProt : P00469 (TYSY_LACCA)
Reaction: EC: Evidence:
Physiological Direction:
(6R)-5,10-methylene-5,6,7,8-tetrahydrofolate + dUMP = 7,8- dihydrofolate + dTMP 2.1.1.45 HAMAP-Rule:MF_00008
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