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Structure paper

TitleApproaches to solving the rigid receptor problem by identifying a minimal set of flexible residues during ligand docking.
Journal, issue, pagesChem. Biol., Vol. 8, Page 445-457, Year 2001
Publish dateMay 23, 2000 (structure data deposition date)
AuthorsAnderson, A.C. / O'Neil, R.H. / Surti, T.S. / Stroud, R.M.
External linksChem. Biol. / PubMed:11358692
MethodsX-ray diffraction
Resolution1.9 Å
Structure data

PDB-1f28:
CRYSTAL STRUCTURE OF THYMIDYLATE SYNTHASE FROM PNEUMOCYSTIS CARINII BOUND TO DUMP AND BW1843U89
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

Chemicals

ChemComp-UMP:
2'-DEOXYURIDINE 5'-MONOPHOSPHATE

ChemComp-F89:
S)-2-(5(((1,2-DIHYDRO-3-METHYL-1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-OXO-2-ISOINDOLINYL)GLUTARIC ACID

ChemComp-HOH:
WATER

Source
  • pneumocystis carinii (fungus)
KeywordsTRANSFERASE / beta-sheet / protein-inhibitor complex

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