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Structure paper

TitleStructure-based design of TACE selective inhibitors: manipulations in the S1'-S3' pocket.
Journal, issue, pagesBioorg. Med. Chem., Vol. 15, Page 6170-6181, Year 2007
Publish dateApr 16, 2007 (structure data deposition date)
AuthorsHuang, A. / Joseph-McCarthy, D. / Lovering, F. / Sun, L. / Wang, W. / Xu, W. / Zhu, Y. / Cui, J. / Zhang, Y. / Levin, J.I.
External linksBioorg. Med. Chem. / PubMed:17606376
MethodsX-ray diffraction
Resolution2.8 Å
Structure data

PDB-2pjt:
Crystal structure of the catalytic domain of MMP-13 complexed with WAY-344
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-CA:
Unknown entry

ChemComp-347:
TERT-BUTYL 4-({[4-(BUT-2-YN-1-YLAMINO)PHENYL]SULFONYL}METHYL)-4-[(HYDROXYAMINO)CARBONYL]PIPERIDINE-1-CARBOXYLATE

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE / MMPS / METALLOPROTEASE / MMP-13 / COLLAGENASE / ZINC CHELATOR / HYDROXAMATE / HYDROPHOBIC S1' / P1' GROUP / Calcium / Collagen degradation / Disease mutation / Extracellular matrix / Glycoprotein / Metal-binding / Polymorphism / Secreted / Zymogen

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