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PDBe Entry: 1d8f view

CRYSTAL STRUCTURE OF MMP3 COMPLEXED WITH A PIPERAZINE BASED INHIBITOR.
Summary
Header HYDROLASEsearch
Method X-RAY DIFFRACTION
Experiment Resolution: 2.4 Å, R-factor: 29.4%, Free R-factor: 25.2%, Spacegroup: P 21 21 21
Released 23/10/2000, deposition: 22/10/1999, last revision: 24/02/2009
Authors Cheng, M.Y.search; De, B.search; Pikul, S.search; Almstead, N.G.search; Natchus, M.G.search; Anastasio, M.V.search; McPhail, S.J.search; Snider, C.E.search; Taiwo, Y.O.search; Chen, L.Y.search
Primary citation Design and synthesis of piperazine-based matrix metalloproteinase inhibitors.
J.MED.CHEM.search vol:43, pag:369-380 (2000) [PubMed ID 10669564 ]search
Keywords MIXED ALPHA BETA STRUCTUREsearch, ZINC PROTEASEsearch, INHIBITEDsearch, HYDROLASEsearch
EC 3.4.24.17 ExPASy BRENDA search (A B)
Organism Homo sapiens(human) 9606search(A B)
UniProt Stromelysin-1 precursor (EC 3.4.24.17) (SL-1) (Matrix metalloproteinase-3) (MMP-3) (Transin-1) P08254search (A B)
Solvent A, B
Related entries 1cqr, 1d5j, 1d7x
Polymers
Id Name Type UniProt Residues Observed
A, B STROMELYSIN-1 PRECURSOR Protein P08254 (MMP3_HUMAN)search
173 100%
Heterogens
Id Name Ligands
A, B ZINC ION ZN search
A, B CALCIUM ION CA search
B N-HYDROXY-1-(4-METHOXYPHENYL)SULFONYL-4-BENZYLOXYCARBONYL-PIPERAZINE-2-CARBOXAMIDE SPI search
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