Ki Summary

Reaction Details

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Target

Peptidyl-prolyl cis-trans isomerase A

Ligand

BDBM50323713

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_645216 (CHEMBL1216020)

IC50

206±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:

Type:

Protein

Mol. Mass.:

18015.32

Organism:

Homo sapiens (Human)

Description:

P62937

Residue:

165

Sequence:

MVNPTVFFDIAVDGEPLGRVSFELFADKVPKTAENFRALSTGEKGFGYKGSCFHRIIPGF
MCQGGDFTRHNGTGGKSIYGEKFEDENFILKHTGPGILSMANAGPNTNGSQFFICTAKTE
WLDGKHVVFGKVKEGMNIVEAMERFGSRNGKTSKKITIADCGQLE

BDBM50323713

n/a

Name

BDBM50323713

Synonyms:

(E/Z)-(R,S,S,S,S,S,R,R,S,S,S,S)-N,N'-(4,4'-(diazene-1,2-diyl)bis(4,1-phenylene))bis(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)acetamide) | (R,S,S,S,S,S,R,R,S,S,S,S,E)-N,N'-(4,4'-((E)-diazene-1,2-diyl)bis(4,1-phenylene))bis(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)acetamide) | CHEMBL1213205

Type

Small organic molecule

Emp. Form.

C140H234N26O28

Mol. Mass.

2729.5134

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=N\c2ccc(NC(=O)COC[C@H]3NC(=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)C(=O)[C@H](CC)NC(=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)C3=O)C(C)C)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|

Structure