| Reaction Details |
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 | Report a problem with these data |
| Target | Peptidyl-prolyl cis-trans isomerase FKBP5 |
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| Ligand | BDBM50432752 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_952910 (CHEMBL2351899) |
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| Ki | 80±n/a nM |
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| Citation |  Wang, Y; Kirschner, A; Fabian, AK; Gopalakrishnan, R; Kress, C; Hoogeland, B; Koch, U; Kozany, C; Bracher, A; Hausch, F Increasing the efficiency of ligands for FK506-binding protein 51 by conformational control. J Med Chem56:3922-35 (2013) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Peptidyl-prolyl cis-trans isomerase FKBP5 |
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| Name: | Peptidyl-prolyl cis-trans isomerase FKBP5 |
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| Synonyms: | 51 kDa FK506-binding protein | 51 kDa FKBP | 54 kDa progesterone receptor-associated immunophilin | AIG6 | Androgen-regulated protein 6 | FF1 antigen | FK506-binding protein 5 | FKBP-5 | FKBP-51 | FKBP5 | FKBP51 | FKBP54 | FKBP5_HUMAN | HSP90-binding immunophilin | PPIase FKBP5 | Rotamase | p54 |
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| Type: | PROTEIN |
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| Mol. Mass.: | 51207.06 |
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| Organism: | Homo sapiens (Human) |
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| Description: | ChEMBL_952910 |
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| Residue: | 457 |
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| Sequence: | MTTDEGAKNNEESPTATVAEQGEDITSKKDRGVLKIVKRVGNGEETPMIGDKVYVHYKGK
LSNGKKFDSSHDRNEPFVFSLGKGQVIKAWDIGVATMKKGEICHLLCKPEYAYGSAGSLP
KIPSNATLFFEIELLDFKGEDLFEDGGIIRRTKRKGEGYSNPNEGATVEIHLEGRCGGRM
FDCRDVAFTVGEGEDHDIPIGIDKALEKMQREEQCILYLGPRYGFGEAGKPKFGIEPNAE
LIYEVTLKSFEKAKESWEMDTKEKLEQAAIVKEKGTVYFKGGKYMQAVIQYGKIVSWLEM
EYGLSEKESKASESFLLAAFLNLAMCYLKLREYTKAVECCDKALGLDSANEKGLYRRGEA
QLLMNEFESAKGDFEKVLEVNPQNKAARLQISMCQKKAKEHNERDRRIYANMFKKFAEQD
AKEEANKAMGKKTSEGVTNEKGTDSQAMEEEKPEGHV
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| BDBM50432752 |
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| n/a |
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| Name | BDBM50432752 |
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| Synonyms: | FK-506 |
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| Type | Small organic molecule |
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| Emp. Form. | C45H71NO12 |
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| Mol. Mass. | 818.0447 |
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| SMILES | CO[C@@H]1C[C@@H](CC[C@H]1O)\C=C\[C@H](C)[C@@H]1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@@H]([C@H](C[C@H]2C)OC)[C@H](C[C@@H](C)CC(C)=C[C@@H](CC=C)C(=O)C[C@H](O)[C@H]1C)OC |r| |
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| Structure | 
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