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Code Name Link
9QR 5-(4-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-6-ethylpyrimidine-2,4-diamine
NAP Nadp nicotinamide-adenine-dinucleotide phosphate
PO4 Phosphate ion
UMP 2'-deoxyuridine 5'-monophosphate
Code : 6A2M   PDBj   RCSB PDB   PDBe
Title : Crystal structure of wild type Plasmodium falciparum DHFR-TS complexed with BT2, NADPH, and dUMP
Release Data : 2019-04-24
Compound :
mol_id molecule chains
1 Bifunctional dihydrofolate reductase-thymidylate synthase A,B
Source :
mol_id organism_scientific organism_common expression_system
1 Plasmodium falciparum  (taxid:5833) Malaria parasite P. falciparum Escherichia coli BL21(DE3)  (taxid:469008)
gene: DHFR-TS, dhfr-ts
expression_system_strain: BL21(DE3)
expression_system_vector_type: plasmid
expression_system_plasmid: pET17b
Authors : Chitnumsub, P., Jaruwat, A., Tarnchampoo, B., Yuthavong, Y.
Keywords : Rossmann fold, Dual-binding Inhibitor, OXIDOREDUCTASE
Exp. method : X-RAY DIFFRACTION ( 2.2000 Å )
Citation :

Hybrid Inhibitors of Malarial Dihydrofolate Reductase with Dual Binding Modes That Can Forestall Resistance.

Tarnchompoo, B.,Chitnumsub, P.,Jaruwat, A.  et al.
(2018)  ACS Med Chem Lett  9 : 1235 - 1240

PubMed: 30613332
DOI: 10.1021/acsmedchemlett.8b00389

Chain : A, B
UniProt : A7UD81 (No found in current UniProtKB/SwissProt)
Reaction : -