3LKJ

Small Molecule Inhibition of the TNF Family Cyokine CD40 Ligand Through a Subunit Fracture Mechanism

Summary for 3LKJ

Entry DOI	10.2210/pdb3lkj/pdb
Descriptor	CD40 ligand, 2-acetamido-2-deoxy-beta-D-glucopyranose, (2R)-{[(2'-[(biphenyl-3-ylmethyl)carbamoyl]-6'-{[(2R)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]carbonyl}-6-{[(2R)-2-(1H-pyrrol-1-ylmethyl)pyrrolidin-1-yl]carbonyl}-4,4'-bipyridin-2-yl)carbonyl]amino}(cyclohexyl)ethanoic acid, ... (4 entities in total)
Functional Keywords	cd40l, cd154, tnf-family cytokine, protein-protein interaction, cell membrane, cytokine, disease mutation, disulfide bond, glycoprotein, membrane, phosphoprotein, secreted, signal-anchor, transmembrane
Biological source	Homo sapiens (human)
Total number of polymer chains	3
Total formula weight	48136.33
Authors	Silvian, L.F.,Whitty, A. (deposition date: 2010-01-27, release date: 2011-02-02, Last modification date: 2023-09-06)
Primary citation	Silvian, L.F.,Friedman, J.E.,Strauch, K.,Cachero, T.G.,Day, E.S.,Qian, F.,Cunningham, B.,Fung, A.,Sun, L.,Su, L.,Zheng, Z.,Kumaravel, G.,Whitty, A. Small Molecule Inhibition of the TNF Family Cytokine CD40 Ligand through a Subunit Fracture Mechanism. Acs Chem.Biol., 6:636-647, 2011 Cited by PubMed: 21417339 DOI: 10.1021/cb2000346 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.5 Å)

Structure validation