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MolNFT v2 · #155906 · protein

Quadruple mutant (N51I+C59R+S108N+I164L) plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS) complexed with B12154

6KP7: “Quadruple mutant (N51I+C59R+S108N+I164L) plasmodium falciparum dihydrofolate reductase-thymidylate synthase…”. X-ray diffraction at 1.97, 3 ligands (NDP, UMP, DQ9). MolNFT v2 #155906 on GenesisL1: 3D structure, binding sites and…

PDB
6KP7
Type
protein
Length
1,053 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.97
Source
Plasmodium falciparum
UniProt
D9N170
Ligands
NDP, UMP, DQ9

Structure

x-ray diffraction · resolution 1.97 · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein520—D9N170
B—protein533—D9N170

Ligands and binding sites

  • NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate · ligand · 2 copies · chains A, B
  • UMP · 2'-deoxyuridine 5'-monophosphate · ligand · 2 copies · chains A, B
  • DQ9 · 2-[3-[3-[2,6-bis(azanyl)-5-(3-chlorophenyl)pyrimidin-4-yl]propoxy]phenoxy]ethanoic acid · ligand · 2 copies · chains A, B
  • GOL · Glycerol · additive · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 6KP7 · Quadruple mutant (N51I+C59R+S108N+I164L) plasmodium falciparum dihydrofolate… · the same entry in another collection · chain A against A, TM-score 1.00

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