Reaction Details Report a problem with these data
Target
Collagenase ColA
Ligand
BDBM50100781
Substrate
n/a
Meas. Tech.
ChEMBL_49485 (CHEMBL659907)
Ki
6±n/a nM
Citation
 Clare, BW; Scozzafava, A; Supuran, CT Protease inhibitors: synthesis of a series of bacterial collagenase inhibitors of the sulfonyl amino acyl hydroxamate type. J Med Chem 44:2253-8 (2001) [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:
BDBM50100781
Synonyms:
CHEMBL73260 | N-Hydroxy-2-[(naphthalene-1-sulfonyl)-(2-nitro-benzyl)-amino]-propionamide
Type:
Small organic molecule
Emp. Form.:
C20H19N3O6S
Mol. Mass.:
429.446
SMILES:
CC(N(Cc1ccccc1[N+]([O-])=O)S(=O)(=O)c1cccc2ccccc12)C(=O)NO
Structure:
Search PDB for entries with ligand similarity: