Von Feldt J M, Monfardini C, Kieber-Emmons T, Voet D, Weiner D B, Williams W V
Department of Medicine, University of Pennsylvania School of Medicine, Philadelphia 19104, USA.
Immunol Res. 1994;13(2-3):96-109. doi: 10.1007/BF02918271.
Development of small molecular mimics of larger polypeptide ligands is an important approach to pharmacophore design. One strategy for the development of such mimics is analysis of alternative ligands that bind to the same site as the native ligand. These allow examination of the structural and chemical constraints for binding within the setting of diverse backbone geometries. The use of antireceptor antibodies as alternative ligands has allowed the development of biologically active peptides in several ligand-receptor systems. This technology has been applied to the study of interactions between human granulocyte-macrophage colony-stimulating factor (GM-CSF) and its receptor (GM-CSFR). GM-CSF is one of a family of signal-transducing cytokines and growth factors characterized by a four-helix bundle core structure. The GM-CSFR is comprised of an alpha-chain (GM-CSFR alpha) specific for GM-CSF, and a beta-chain (beta c) shared with the interleukin-3 and interleukin-5 receptors. At least two sites on GM-CSF have been implicated in the GM-CSF-GM-CSFR alpha/beta c ternary complex. In studies summarized here, synthetic peptide analogs of GM-CSF sequences were designed and used to map neutralizing epitopes. One neutralizing epitope corresponded to the A helix of GM-CSF, and a synthetic analog displayed biological activity as a GM-CSF antagonist in vitro, suggesting interaction with the GM-CSFR alpha/beta c complex. A second peptide comprising the B and C helices was recognized by monoclonal neutralizing antibodies and similarly displayed antagonist activity. Recombinant antibody (rAb) technology was also employed. An expression library of rAbs from mice immunized with neutralizing anti-GM-CSF antibodies was developed and screened with a neutralizing anti-GM-CSF monoclonal antibody. One clone which displayed receptor binding activity exhibited structural similarity with epitopes on GM-CSF previously implicated as interaction sites with the neutralizing monoclonal antibody. A synthetic peptide analog of the rAb inhibited GM-CSF bioactivity. Critical contact residues were predicted on the basis of structural similarity of the rAb peptide and GM-CSF. These studies indicate the feasibility of using rAbs in bioactive peptide design, providing lead compounds and information regarding contact residues for drug design.
开发较大多肽配体的小分子模拟物是药效团设计的重要方法。开发此类模拟物的一种策略是分析与天然配体结合于同一位点的替代配体。这使得能够在不同主链几何结构的背景下研究结合的结构和化学限制。使用抗受体抗体作为替代配体已在多个配体 - 受体系统中实现了生物活性肽的开发。该技术已应用于人类粒细胞 - 巨噬细胞集落刺激因子(GM - CSF)与其受体(GM - CSFR)之间相互作用的研究。GM - CSF是一类信号转导细胞因子和生长因子家族成员之一,其特征为四螺旋束核心结构。GM - CSFR由对GM - CSF特异的α链(GM - CSFRα)和与白细胞介素 - 3及白细胞介素 - 5受体共有的β链(βc)组成。GM - CSF上至少有两个位点参与GM - CSF - GM - CSFRα/βc三元复合物的形成。在此总结的研究中,设计了GM - CSF序列的合成肽类似物并用于绘制中和表位。一个中和表位对应于GM - CSF的A螺旋,一种合成类似物在体外作为GM - CSF拮抗剂表现出生物活性,提示其与GM - CSFRα/βc复合物相互作用。包含B和C螺旋的第二种肽被单克隆中和抗体识别且同样表现出拮抗剂活性。还采用了重组抗体(rAb)技术。构建了用中和抗GM - CSF抗体免疫的小鼠的rAb表达文库,并用中和抗GM - CSF单克隆抗体进行筛选。一个表现出受体结合活性的克隆与GM - CSF上先前被认为是与中和单克隆抗体相互作用位点的表位具有结构相似性。该rAb的合成肽类似物抑制GM - CSF生物活性。基于rAb肽与GM - CSF的结构相似性预测了关键接触残基。这些研究表明在生物活性肽设计中使用rAb的可行性,为药物设计提供了先导化合物和有关接触残基的信息。