Liu Group
P3DOCK
HELP
Result Example
PRIME
3dRPC
RMalign

P3DOCK is a hybrid docking method based on free and template-based docking. For free docking, it employs 3dRPC which takes into account protein/RNA geometric and eletrostatic complementarity. For template-based docking, it uses PRIME which employs TMalign to align protein and RMalign to align RNA to search templates and build models.
Input:
First, the protein and RNA structures that you want to dock must be provided by the following two ways:
  • 1. Provide a PDB id. If you provide structure by this way, the webserver will fetch the structure from PDB.
  • 2. Upload a file
  • Second, the chain id must be assigned.
    Parameters configure:
    The detail parameters of P3DOCK also can be set. However, we would not suggest changing the default parameters.
  • If you have the native structure and want to calcaulate the RMSD. Please provide the native structure and assign the chain id(default false).
  • The models can be sorted by TM-score (default) and TR-score.
  • The score cutoff can be set as a float value between 0 and 1(default 0.35). Please noted that models that less than cutoff will be discarded.
  • model number: the number of complexes with pdb format output by P3DOCK.
  • docking type: template-based or hybrid (default template-based docking).

  • References:
    1. Jinfang Zheng, Xu Hong, Juan Xie, Xiaoxue Tong, Shiyong Liu. P3DOCK: a protein-RNA docking webserver based on template-based and template-free docking. Bioinformatics
    2. Jinfang Zheng, Petras J.Kundrotas, Ilya A.V akser and Shiyong Liu. Template-based modeling of protein-RNA interactions. PLOS Computational Biology
    3. Yangyu Huang, Shiyong Liu, Dachuan Guo, Lin Li, Yi Xiao. A novel protocol for three-dimensional structure prediction of RNA-protein complexes. Scientific reports