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TitleCrystal structures of novel non-peptidic, non-zinc chelating inhibitors bound to MMP-12.
Journal, issue, pagesJ. Mol. Biol., Vol. 341, Page 1063-1076, Year 2004
Publish dateDec 2, 2003 (structure data deposition date)
AuthorsMorales, R. / Perrier, S. / Florent, J.M. / Beltra, J. / Dufour, S. / De Mendez, I. / Manceau, P. / Tertre, A. / Moreau, F. / Compere, D. ...Morales, R. / Perrier, S. / Florent, J.M. / Beltra, J. / Dufour, S. / De Mendez, I. / Manceau, P. / Tertre, A. / Moreau, F. / Compere, D. / Dublanchet, A.C. / O'Gara, M.
External linksJ. Mol. Biol. / PubMed:15289103
MethodsX-ray diffraction
Resolution2 - 2.5 Å
Structure data

PDB-1ros:
Crystal structure of MMP-12 complexed to 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl-4-(4-ethoxy[1,1-biphenyl]-4-yl)-4-oxobutanoic acid
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-1utt:
Crystal Structure of MMP-12 complexed to 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl-4-(4-ethoxy[1,1-biphenyl]-4-yl)-4-oxobutanoic acid
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-1utz:
Crystal Structure of MMP-12 complexed to (2R)-3-({[4-[(pyridin-4-yl)phenyl]-thien-2-yl}carboxamido)(phenyl)propanoic acid
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-CA:
Unknown entry

ChemComp-DEO:
2-[2-(1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)ETHYL]-4-(4'-ETHOXY-1,1'-BIPHENYL-4-YL)-4-OXOBUTANOIC ACID

ChemComp-HOH:
WATER

ChemComp-HAE:
ACETOHYDROXAMIC ACID / medication*YM

ChemComp-CP8:
2-(1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL) ETHYL-4-(4'-ETHOXY [1,1'-BIPHENYL]-4-YL)-4-OXOBUTANOIC ACID

ChemComp-PF3:
(2R)-3-({[4-[(PYRIDIN-4-YL)PHENYL]-THIEN-2-YL}CARBOXAMIDO)(PHENYL)PROPANOIC ACID

Source
  • homo sapiens (human)
KeywordsHYDROLASE / Macrophage metalloelastase / non-zinc chelator / MMP-12 / MMP12 inhibitor / MMP INHIBITOR / METALLOPROTEASE

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