Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetCollagenase 3
LigandBDBM50098914
Substrate/Competitorn/a
Meas. Tech.ChEBML_106619
IC50 2.1±n/a nM
Citation Pikul, SDunham, KMAlmstead, NGDe, BNatchus, MGTaiwo, YOWilliams, LEHynd, BAHsieh, LCJanusz, MJGu, FMieling, GE Heterocycle-based MMP inhibitors with P2' substituents. Bioorg Med Chem Lett11:1009-13 (2001) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Collagenase 3
Name:Collagenase 3
Synonyms:Collagenase 3 | MMP-13 | MMP13_RAT | Matrix metalloproteinase 13 | Matrix metalloproteinase-13 | Mmp13 | UMRCASE
Type:PROTEIN
Mol. Mass.:53359.23
Organism:Rattus norvegicus
Description:ChEMBL_424298
Residue:466
Sequence:
ATFFLLSWTHCWSLPLPYGDDDDDDLSEEDLEFAEHYLKSYYHPVTLAGILKKSTVTSTV
DRLREMQSFFGLDVTGKLDDPTLDIMRKPRCGVPDVGVYNVFPRTLKWSQTNLTYRIVNY
TPDISHSEVEKAFRKAFKVWSDVTPLNFTRIHDGTADIMISFGTKEHGDFYPFDGPSGLL
AHAFPPGPNLGGDAHFDDDETWTSSSKGYNLFIVAAHELGHSLGLDHSKDPGALMFPIYT
YTGKSHFMLPDDDVQGIQSLYGPGDEDPNPKHPKTPEKCDPALSLDAITSLRGETMIFKD
RFFWRLHPQQVEPELFLTKSFWPELPNHVDAAYEHPSRDLMFIFRGRKFWALNGYDIMEG
YPRKISDLGFPKEVKRLSAAVHFEDTGKTLFFSGNHVWSYDDANQTMDKDYPRLIEEEFP
GIGDKVDAVYEKNGYIYFFNGPIQFEYSIWSNRIVRVMPTNSLLWC
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50098914
n/a
NameBDBM50098914
Synonyms:(R)-5-Hydroxycarbamoyl-4-(4-methoxy-benzenesulfonyl)-[1,4]diazepane-1-carboxylic acid benzyl ester | CHEMBL267939
TypeSmall organic molecule
Emp. Form.C21H25N3O7S
Mol. Mass.463.504
SMILESCOc1ccc(cc1)S(=O)(=O)N1CCN(CC[C@@H]1C(=O)NO)C(=O)OCc1ccccc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: