Brand  (β version)

color scheme of protein:

hetatm:

x
information
centroid:
interaction residue:

chain:

Ligands
Code Name Link
93E 3-chloranylpyridin-2-amine
Code : 5NOQ
Header : ISOMERASE
Title : Structure of cyclophilin A in complex with 3-chloropyridin-2-amine
Release Data : 2017-07-12
Compound :
mol_id molecule chains synonym
1 Peptidyl-prolyl cis-trans isomerase A A PPIase A,Cyclophilin A,Cyclosporin A-binding protein,Rotamase A
ec: 5.2.1.8
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Escherichia coli  (taxid:562)
gene: PPIA, CYPA
Authors : Georgiou, C., Mcnae, I.W., Ioannidis, H., Julien, M., Walkinshaw, M.D.
Keywords : LIGAND COMPLEX, BETA BARREL, PROLYL CIS/TRANS ISOMERASE, CYTOSOLIC, isomerase
Exp. method : X-RAY DIFFRACTION ( 1.60 Å )
Citation :

Pushing the Limits of Detection of Weak Binding Using Fragment-Based Drug Discovery: Identification of New Cyclophilin Binders.

Georgiou, C.,McNae, I.,Wear, M.  et al.
(2017)  J. Mol. Biol.  429 : 2556 - 2570

PubMed: 28673552
DOI: 10.1016/j.jmb.2017.06.016

Chain : A
UniProt : P62937 (PPIA_HUMAN)
Reaction : Peptidylproline (omega=180) = peptidylproline (omega=0).