Brand  (β version)

color scheme of protein:

hetatm:

x
information
centroid:
interaction residue:

chain:

Ligands
Code Name Link
CL Chloride ion
MG Magnesium ion
0KC {2-[2-(cyclopentylamino)-2-oxoethoxy]phenyl}phosphonic acid
GOL Glycerol
Code : 4DHN
Header : PROTEIN BINDING/INHIBITOR
Title : Small-molecule inhibitors of 14-3-3 protein-protein interactions from virtual screening
Release Data : 2013-07-31
Compound :
mol_id molecule chains synonym
1 14-3-3 protein sigma A Epithelial cell marker protein 1, Stratifin
fragment: UNP residues 1-231
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Escherichia coli  (taxid:469008)
gene: HME1, SFN
expression_system_strain: ROSETTA DE3
expression_system_vector_type: PLASMID
expression_system_plasmid: PPROEX HTB
Authors : Thiel, P., Roeglin, L., Kohlbacher, O., Ottmann, C.
Keywords : HELICAL PROTEIN, ADAPTER PROTEIN, PHOSPHOPROTEIN BINDING, PROTEIN BINDING-INHIBITOR complex
Exp. method : X-RAY DIFFRACTION ( 1.8000 Å )
Citation :

Virtual screening and experimental validation reveal novel small-molecule inhibitors of 14-3-3 protein-protein interactions.

Thiel, P.,Roglin, L.,Meissner, N.  et al.
(2013)  Chem.Commun.(Camb.)  49 : 8468 - 8470

PubMed: 23939230
DOI: 10.1039/c3cc44612c

Chain : A
UniProt : P31947 (1433S_HUMAN)
Reaction : -