Target
14-3-3 protein zeta/delta
Ligand
BDBM50246116
Substrate
n/a
Meas. Tech.
ChEMBL_1676464 (CHEMBL4026607)
Kd
59±n/a nM
Citation
 Krüger, DMGlas, ABier, DPospiech, NWallraven, KDietrich, LOttmann, CKoch, OHennig, SGrossmann, TN Structure-Based Design of Non-natural Macrocyclic Peptides That Inhibit Protein-Protein Interactions. J Med Chem 60:8982-8988 (2017) [PubMed]  Article 
Target
Name:
14-3-3 protein zeta/delta
Synonyms:
14-3-3 protein zeta/delta | 1433Z_HUMAN | KCIP-1 | Protein kinase C inhibitor protein 1 | YWHAZ
Type:
PROTEIN
Mol. Mass.:
27731.18
Organism:
Homo sapiens
Description:
ChEMBL_117504
Residue:
245
Sequence:
MDKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTSDTQGDEAEAGEGGEN
  
Inhibitor
Name:
BDBM50246116
Synonyms:
CHEMBL4063253
Type:
Small organic molecule
Emp. Form.:
C90H127N15O25S
Mol. Mass.:
1851.122
SMILES:
CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@]1(C)CCCCCCCCCCCC[C@](C)(NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)COCCOCCNC(=S)Nc2ccc3c(c2)C(=O)OC32c3ccc(O)cc3Oc3cc(O)ccc23)C(=O)N[C@H](C(=O)N[C@@H](CC(O)=O)C(=O)N1)C12CC3CC(CC(C3)C1)C2)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r,TLB:95:107:110:114.112.113,THB:112:111:108:114.113.115,112:113:110.111.116:108,115:113:110:116.107.108,115:107:110:114.112.113|
Structure:
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