1I76

COMPLEX OF 2-(BIPHENYL-4-SULFONYL)-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID (D-TIC DERIVATIVE) WITH T CATALITIC DOMAIN OF MATRIX METALLO PROTEINASE-8 (MET80 FORM)

Summary for 1I76

Related1JAP 1BZS 1I73
DescriptorNEUTROPHIL COLLAGENASE, CALCIUM ION, ZINC ION, ... (5 entities in total)
Functional Keywordshydrolase, complex (metalloprotease-inhibitor)
Biological sourceHomo sapiens (human)
Cellular locationCytoplasmic granule P22894
Total number of polymer chains1
Total molecular weight18716.17
Authors
Gavuzzo, E.,Pochetti, G.,Mazza, F.,Gallina, C.,Gorini, B.,D'Alessio, S.,Pieper, M.,Tschesche, H.,Tucker, P.A. (deposition date: 2001-03-08, release date: 2001-03-21, Last modification date: 2018-01-24)
Primary citation
Gavuzzo, E.,Pochetti, G.,Mazza, F.,Gallina, C.,Gorini, B.,D'Alessio, S.,Pieper, M.,Tschesche, H.,Tucker, P.A.
Two crystal structures of human neutrophil collagenase, one complexed with a primed- and the other with an unprimed-side inhibitor: implications for drug design.
J.Med.Chem., 43:3377-3385, 2000
PubMed: 10978185 (PDB entries with the same primary citation)
DOI: 10.1021/jm9909589
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.2 Å)
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Structure validation

ClashscoreRamachandran outliersSidechain outliersRSRZ outliers306.1%4.9%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution