Ligand: O44

Total number of chains: 1
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGout BBAminus 1 100.0% 5U8LA

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Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT APEtype APEdihe APEdist Ligand Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein
TYR EGFR EGFR_HUMAN 5U8LA 1.6 Inactive DFGout‑BBAminus out-out in-in TYR APEdihe_iiiai APEdist_aaai O44 Type1 702 - 990 0 None None Epidermal growth factor receptor

Ligand: O44

Total number of chains: 3
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 33.3% 5K9IA
DFGout BBAminus 1 33.3% 5U8LA
DFGout None 1 33.3% 5K9IB

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Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT APEtype APEdihe APEdist Ligand Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein Organism
TYR SRC SRC_CHICK 5K9IA 2.5 Inactive DFGin‑BLAminus out-out none-none TYR APEdihe_nniai APEdist_aaai O44 Type1 259 - 533 0 None None Proto-oncogene tyrosine-protein kinase Src Gallus gallus
TYR SRC SRC_CHICK 5K9IB 2.5 Inactive DFGout‑None out-out in-none TYR APEdihe_nniai APEdist_aaai O44 Type1 259 - 533 0 None None Proto-oncogene tyrosine-protein kinase Src Gallus gallus
TYR EGFR EGFR_HUMAN 5U8LA 1.6 Inactive DFGout‑BBAminus out-out in-in TYR APEdihe_iiiai APEdist_aaai O44 Type1 702 - 990 0 None None Epidermal growth factor receptor Homo sapiens

Ligand: O44

Total number of chains: 2
Active chains: 0
Total number of genes: 1
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 1 50.0% 5K9IA
DFGout None 1 50.0% 5K9IB

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Family Gene UniprotID PDB Resolution Activity Spatial-Dihedral Chelix-SaltBridge ActLoopNT-ActLoopCT APEtype APEdihe APEdist Ligand Ligand Type Residues in structure Unresolved residues in A-loop Phosphorylation Mutation Protein Organism
TYR SRC SRC_CHICK 5K9IA 2.5 Inactive DFGin‑BLAminus out-out none-none TYR APEdihe_nniai APEdist_aaai O44 Type1 259 - 533 0 None None Proto-oncogene tyrosine-protein kinase Src Gallus gallus
TYR SRC SRC_CHICK 5K9IB 2.5 Inactive DFGout‑None out-out in-none TYR APEdihe_nniai APEdist_aaai O44 Type1 259 - 533 0 None None Proto-oncogene tyrosine-protein kinase Src Gallus gallus