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Structure paper

TitleTernary complex structures of human farnesyl pyrophosphate synthase bound with a novel inhibitor and secondary ligands provide insights into the molecular details of the enzyme's active site closure.
Journal, issue, pagesBmc Struct. Biol., Vol. 12, Page 32-32, Year 2012
Publish dateSep 18, 2012 (structure data deposition date)
AuthorsPark, J. / Lin, Y.S. / De Schutter, J.W. / Tsantrizos, Y.S. / Berghuis, A.M.
External linksBmc Struct. Biol. / PubMed:23234314
MethodsX-ray diffraction
Resolution2.02 - 2.04 Å
Structure data

PDB-4h5c:
Crystal structure of human FPPS in ternary complex with YS0470 and inorganic phosphate
Method: X-RAY DIFFRACTION / Resolution: 2.02 Å

PDB-4h5d:
Crystal structure of human FPPS in ternary complex with YS0470 and inorganic pyrophosphate
Method: X-RAY DIFFRACTION / Resolution: 2.02 Å

PDB-4h5e:
Crystal structure of human FPPS in ternary complex with YS0470 and isopentenyl pyrophosphate
Method: X-RAY DIFFRACTION / Resolution: 2.04 Å

Chemicals

ChemComp-YS4:
[({4-[4-(propan-2-yloxy)phenyl]pyridin-2-yl}amino)methanediyl]bis(phosphonic acid)

ChemComp-PO4:
PHOSPHATE ION

ChemComp-MG:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-POP:
PYROPHOSPHATE 2-

ChemComp-IPR:
ISOPENTYL PYROPHOSPHATE

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / Transferase / TRANSFERASE-TRANSFERASE INHIBITOR complex

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