3F19

Crystal structure of the catalytic domain of human MMP12 complexed with the inhibitor 4-fluoro-N-(2-nitroso-2-oxoethyl)benzenesulfonamide

Summary for 3F19

Related3F15 3F16 3F17 3F18 3F1A
DescriptorMacrophage metalloelastase, ZINC ION, CALCIUM ION, ... (5 entities in total)
Functional Keywordsmatrix metalloproteinase, mmp12, elastase, complex (elastase-inhibitor), metallo elastase, calcium, extracellular matrix, glycoprotein, hydrolase, metal-binding, metalloprotease, polymorphism, protease, secreted, zinc, zymogen
Biological sourceHomo sapiens
Cellular locationSecreted, extracellular space, extracellular matrix (Probable) P39900
Total number of polymer chains1
Total molecular weight17981.74
Authors
Calderone, V. (deposition date: 2008-10-27, release date: 2008-11-18, Last modification date: 2011-07-13)
Primary citation
Bertini, I.,Calderone, V.,Fragai, M.,Giachetti, A.,Loconte, M.,Luchinat, C.,Maletta, M.,Nativi, C.,Yeo, K.J.
Exploring the subtleties of drug-receptor interactions: the case of matrix metalloproteinases.
J.Am.Chem.Soc., 129:2466-2475, 2007
PubMed: 17269766 (PDB entries with the same primary citation)
DOI: 10.1021/ja065156z
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.13 Å)
NMR Information
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.182200.8%10.1%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution