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Target
Proteasome subunit beta type-10
Ligand
BDBM50517651
Substrate
n/a
Meas. Tech.
ChEMBL_1869378 (CHEMBL4370444)
IC50
97±n/a nM
Citation
 Xin, BT; Huber, EM; de Bruin, G; Heinemeyer, W; Maurits, E; Espinal, C; Du, Y; Janssens, M; Weyburne, ES; Kisselev, AF; Florea, BI; Driessen, C; van der Marel, GA; Groll, M; Overkleeft, HS Structure-Based Design of Inhibitors Selective for Human Proteasome ?2c or ?2i Subunits. J Med Chem 62:1626-1642 (2019) [PubMed]  Article 
Target
Name:
Proteasome subunit beta type-10
Synonyms:
LMP10 | Low molecular mass protein 10 | MECL1 | Macropain subunit MECl-1 | Multicatalytic endopeptidase complex subunit MECl-1 | PSB10_HUMAN | PSMB10 | Proteasome MECl-1 | Proteasome subunit beta-2i
Type:
PROTEIN
Mol. Mass.:
28940.51
Organism:
Homo sapiens (Human)
Description:
ChEMBL_106197
Residue:
273
Sequence:
MLKPALEPRGGFSFENCQRNASLERVLPGLKVPHARKTGTTIAGLVFQDGVILGADTRATNDSVVADKSCEKIHFIAPKIYCCGAGVAADAEMTTRMVASKMELHALSTGREPRVATVTRILRQTLFRYQGHVGASLIVGGVDLTGPQLYGVHPHGSYSRLPFTALGSGQDAALAVLEDRFQPNMTLEAAQGLLVEAVTAGILGDLGSGGNVDACVITKTGAKLLRTLSSPTEPVKRSGRYHFVPGTTAVLTQTVKPLTLELVEETVQAMEVE
  
Inhibitor
Name:
BDBM50517651
Synonyms:
CHEMBL4539247
Type:
Small organic molecule
Emp. Form.:
C37H51N7O5
Mol. Mass.:
673.8447
SMILES:
CC(C)[C@H](NC(=O)[C@H](Cc1ccc(CN)cc1)NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](CC1CCC(C)CC1)C(=O)[C@@]1(C)CO1 |r,wU:7.7,34.36,20.29,wD:3.2,45.48,(66.53,-40.02,;65.2,-39.25,;63.87,-40.02,;65.2,-37.71,;63.87,-36.94,;62.53,-37.71,;62.53,-39.25,;61.2,-36.94,;61.2,-35.4,;60.1,-34.32,;60.49,-32.83,;59.39,-31.75,;57.9,-32.16,;56.8,-31.08,;55.32,-31.5,;57.52,-33.66,;58.62,-34.74,;59.87,-37.71,;58.53,-36.94,;58.53,-35.4,;57.2,-37.71,;55.86,-36.94,;54.53,-37.71,;53.2,-36.94,;51.87,-37.71,;51.86,-39.25,;53.21,-40.02,;54.53,-39.25,;57.2,-39.25,;58.53,-40.02,;59.86,-40.79,;66.53,-36.94,;66.53,-35.4,;67.87,-37.71,;69.2,-36.94,;69.2,-35.4,;68,-34.21,;66.57,-34.76,;65.38,-33.8,;65.61,-32.28,;64.41,-31.32,;67.05,-31.71,;68.24,-32.69,;70.53,-37.71,;70.53,-39.25,;71.87,-36.94,;73.2,-37.71,;71.09,-35.6,;72.64,-35.59,)|
Structure:
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