Reaction Details Report a problem with these data
Target
Collagenase ColA
Ligand
BDBM50086766
Substrate
n/a
Meas. Tech.
ChEBML_49486
Ki
2100±n/a nM
Citation
 Scozzafava, A; Supuran, CT Protease inhibitors: synthesis of clostridium histolyticum collagenase inhibitors incorporating sulfonyl-L-alanine hydroxamate moieties. Bioorg Med Chem Lett 10:499-502 (2000) [PubMed]  Article 
Target
Name:
Collagenase ColA
Synonyms:
120 kDa collagenase | COLA_CLOPE | Microbial collagenase | colA
Type:
PROTEIN
Mol. Mass.:
125901.02
Organism:
Clostridium perfringens
Description:
ChEMBL_49485
Residue:
1104
Sequence:
MKKNLKRGELTKLKLVERWSATFTLAAFILFNSSFKVLAADKKVENSNNGQITREINADQISKTELNNEVATDNNRPLGPSIAPSRARNNKIYTFDELNRMNYSDLVELIKTISYENVPDLFNFNDGSYTFFSNRDRVQAIIYGLEDSGRTYTADDDKGIPTLVEFLRAGYYLGFYNKQLSYLNTPQLKNECLPAMKAIQYNSNFRLGTKAQDGVVEALGRLIGNASADPEVINNCIYVLSDFKDNIDKYGSNYSKGNAVFNLMKGIDYYTNSVIYNTKGYDAKNTEFYNRIDPYMERLESLCTIGDKLNNDNAWLVNNALYYTGRMGKFREDPSISQRALERAMKEYPYLSYQYIEAANDLDLNFGGKNSSGNDIDFNKIKADAREKYLPKTYTFDDGKFVVKAGDKVTEEKIKRLYWASKEVKAQFMRVVQNDKALEEGNPDDILTVVIYNSPEEYKLNRIINGFSTDNGGIYIENIGTFFTYERTPEESIYTLEELFRHEFTHYLQGRYVVPGMWGQGEFYQEGVLTWYEEGTAEFFAGSTRTDGIKPRKSVTQGLAYDRNNRMSLYGVLHAKYGSWDFYNYGFALSNYMYNNNMGMFNKMTNYIKNNDVSGYKDYIASMSSDYGLNDKYQDYMDSLLNNIDNLDVPLVSDEYVNGHEAKDINEITNDIKEVSNIKDLSSNVEKSQFFTTYDMRGTYVGGRSQGEENDWKDMNSKLNDILKELSKKSWNGYKTVTAYFVNHKVDGNGNYVYDVVFHGMNTDTNTDVHVNKEPKAVIKSDSSVIVEEEINFDGTESKDEDGEIKAYEWDFGDGEKSNEAKATHKYNKTGEYEVKLTVTDNNGGINTESKKIKVVEDKPVEVINESEPNNDFEKANQIAKSNMLVKGTLSEEDYSDKYYFDVAKKGNVKITLNNLNSVGITWTLYKEGDLNNYVLYATGNDGTVLKGEKTLEPGRYYLSVYTYDNQSGTYTVNVKGNLKNEVKETAKDAIKEVENNNDFDKAMKVDSNSKIVGTLSNDDLKDIYSIDIQNPSDLNIVVENLDNIKMNWLLYSADDLSNYVDYANADGNKLSNTCKLNPGKYYLCVYQFENSGTGNYIVNLQNK
  
Inhibitor
Name:
BDBM50086766
Synonyms:
2-[(3-tert-Butoxycarbonylamino-4-methoxy-benzenesulfonyl)-(4-nitro-benzyl)-amino]-propionic acid | CHEMBL146642
Type:
Small organic molecule
Emp. Form.:
C22H27N3O9S
Mol. Mass.:
509.529
SMILES:
COc1ccc(cc1NC(=O)OC(C)(C)C)S(=O)(=O)N(Cc1ccc(cc1)[N+]([O-])=O)C(C)C(O)=O
Structure:
Search PDB for entries with ligand similarity: