Ligand: 8JC (Rociletinib)

Total number of chains: 2
Spatial label Dihedral label Number of Chains Representative
DFGin BLAminus 2 5XDKA
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Database table as tsv

Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein
TYR EGFR EGFR_HUMAN 5XDKA 2.346 Active DFGin‑BLAminus in-in in-in 8JC Type1 696 - 1018 0 None T790M Epidermal growth factor receptor
TYR EGFR EGFR_HUMAN 5XDLA 2.7 None DFGin‑BLAminus in-in in-none 8JC Type1 696 - 1018 15 None L858R Epidermal growth factor receptor

Ligand: 8JC (Rociletinib)

Total number of chains: 2
Spatial label Dihedral label Number of Chains Representative
DFGin BLAminus 2 5XDKA
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Database table as tsv

Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein Organism
TYR EGFR EGFR_HUMAN 5XDKA 2.346 Active DFGin‑BLAminus in-in in-in 8JC Type1 696 - 1018 0 None T790M Epidermal growth factor receptor Homo sapiens
TYR EGFR EGFR_HUMAN 5XDLA 2.7 None DFGin‑BLAminus in-in in-none 8JC Type1 696 - 1018 15 None L858R Epidermal growth factor receptor Homo sapiens

Ligand: 8JC (Rociletinib)

Total number of chains: 0
Spatial label Dihedral label Number of Chains Representative
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Database table as tsv

Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein Organism