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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Peptidyl-prolyl cis-trans isomerase A | ||
| Ligand | BDBM50323714 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_645220 (CHEMBL1216024) | ||
| IC50 | 950±n/a nM | ||
| Citation |  Zhang, Y; Erdmann, F; Fischer, G Augmented photoswitching modulates immune signaling. Nat Chem Biol5:724-6 (2009) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Peptidyl-prolyl cis-trans isomerase A | |||
| Name: | Peptidyl-prolyl cis-trans isomerase A | ||
| Synonyms: | CYPA | CYPA PPIase | Cyclophilin A | Cyclosporin A-binding protein | PPIA | PPIA_HUMAN | PPIase A | Peptidyl-prolyl cis-trans isomerase A | Rotamase A | ||
| Type: | Protein | ||
| Mol. Mass.: | 18015.32 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P62937 | ||
| Residue: | 165 | ||
| Sequence: |
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| BDBM50323714 | |||
| n/a | |||
| Name | BDBM50323714 | ||
| Synonyms: | CHEMBL1213206 | CHEMBL1213210 | N-(4-((Z)-(4-(2-(((2R,5S,8S,11S,14S,17S,23S,26S,29S,32S)-17-ethyl-14-((1R,2R,E)-1-hydroxy-2-methylhex-4-enyl)-5,8,23,29-tetraisobutyl-11,26-diisopropyl-4,7,10,13,19,22,28,32-octamethyl-3,6,9,12,15,18,21,24,27,30,33-undecaoxo-1,4,7,10,13,16,19,22,25,28,31-undecaazacyclotritriacontan-2-yl)methoxy)acetamido)phenyl)diazenyl)phenyl)-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide | ||
| Type | Small organic molecule | ||
| Emp. Form. | C86H137N17O16S | ||
| Mol. Mass. | 1697.177 | ||
| SMILES | CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](COCC(=O)Nc2ccc(cc2)N=Nc2ccc(NC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@H]34)cc2)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C |r,w:59.60| | ||
| Structure | 
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