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Structure paper

TitleSite-directed ligand discovery.
Journal, issue, pagesProc. Natl. Acad. Sci. USA, Vol. 97, Page 9367-9372, Year 2000
Publish dateJun 7, 2000 (structure data deposition date)
AuthorsErlanson, D.A. / Braisted, A.C. / Raphael, D.R. / Randal, M. / Stroud, R.M. / Gordon, E.M. / Wells, J.A.
External linksProc. Natl. Acad. Sci. USA / PubMed:10944209
MethodsX-ray diffraction
Resolution1.75 - 2.15 Å
Structure data

PDB-1f4b:
CRYSTAL STRUCTURE OF ESCHERICHIA COLI THYMIDYLATE SYNTHASE
Method: X-RAY DIFFRACTION / Resolution: 1.75 Å

PDB-1f4c:
CRYSTAL STRUCTURE OF E. COLI THYMIDYLATE SYNTHASE COVALENTLY MODIFIED AT C146 WITH N-[TOSYL-D-PROLINYL]AMINO-ETHANETHIOL
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-1f4d:
CRYSTAL STRUCTURE OF E. COLI THYMIDYLATE SYNTHASE C146S, L143C COVALENTLY MODIFIED AT C143 WITH N-[TOSYL-D-PROLINYL]AMINO-ETHANETHIOL
Method: X-RAY DIFFRACTION / Resolution: 2.15 Å

PDB-1f4e:
CRYSTAL STRUCTURE OF E. COLI THYMIDYLATE SYNTHASE COMPLEXED WITH TOSYL-D-PROLINE
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-1f4f:
CRYSTAL STRUCTURE OF E. COLI THYMIDYLATE SYNTHASE COMPLEXED WITH SP-722
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-1f4g:
CRYSTAL STRUCTURE OF E. COLI THYMIDYLATE SYNTHASE COMPLEXED WITH SP-876
Method: X-RAY DIFFRACTION / Resolution: 1.75 Å

Chemicals

ChemComp-SO4:
SULFATE ION

ChemComp-GOL:
GLYCEROL

ChemComp-HOH:
WATER

ChemComp-TP2:
N-[TOSYL-D-PROLINYL]AMINO-ETHANETHIOL

ChemComp-TPR:
TOSYL-D-PROLINE

ChemComp-TP3:
4-[[GLUTAMIC ACID]-CARBONYL]-BENZENE-SULFONYL-D-PROLINE

ChemComp-TP4:
N-[4-[[GLUTAMIC ACID]-CARBONYL]-BENZENE-SULFONYL-D-PROLINYL]-3-AMINO-PROPANOIC ACID

Source
  • escherichia coli (E. coli)
KeywordsTRANSFERASE / E. coli thymidylate synthase / E. Coli Thymidylate Synthase Modified at Cysteine 146 / Crystal Structure of E. Coli Thymidylate Synthase C146S / L143C Covalently Modified at C143 with N-[TOSYL-D-PROLINYL]AMINO-ETHANETHIOL / Crystal Structure of E. Coli Thymidylate Synthase Complexed with Tosyl-D-Proline / Crystal Structure of E. Coli Thymidylate Synthase Complexed with SP-722 / Crystal Structure of E. Coli Thymidylate Synthase Complexed with SP-876

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