Ligand: IRE (Gefitinib)

Total number of chains: 11
Active chains: 1
Total number of genes: 3
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 5 45.5% 4WKQA
DFGin ABAminus 3 27.3% 5Y7ZA
DFGinter None 2 18.2% 9D5HA
DFGin BLBtrans 1 9.1% 4I22A
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
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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
OTHER GAK GAK_HUMAN 5Y7ZA 2.804 Inactive DFGin‑ABAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii IRE Type1 25 - 335 0 None None Cyclin-G-associated kinase
OTHER GAK GAK_HUMAN 5Y7ZB 2.804 Inactive DFGin‑ABAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii IRE Type1 25 - 335 0 None None Cyclin-G-associated kinase
OTHER GAK GAK_HUMAN 5Y80A 2.5 Inactive DFGin‑ABAminus in-in in-out nonTYR APEdihe_aaiii APEdist_oioo IRE, IRE Type1, Allosteric 25 - 332 0 None None Cyclin-G-associated kinase
TKL ILK ILK_HUMAN 9D5HA 1.5 Pseudo DFGinter‑None out-out out-out nonTYR APEdihe_aaini APEdist_oooo IRE Type1 182 - 452 0 None C346S,R371Q,C422S Scaffold protein ILK
TKL ILK ILK_HUMAN 9D5EA 1.5 Pseudo DFGinter‑None out-out out-out nonTYR APEdihe_aaini APEdist_oioo IRE, IRE Type1, Type1 182 - 452 0 None C346S,C422S Scaffold protein ILK
TYR EGFR EGFR_HUMAN 3UG2A 2.5 Inactive DFGin‑BLAminus in-out in-in TYR APEdihe_iiiai APEdist_aaai IRE Type1 697 - 1018 0 None G719S,T790M Epidermal growth factor receptor
TYR EGFR EGFR_HUMAN 2ITYA 3.42 None DFGin‑BLAminus in-in in-none TYR APEdihe_nniai APEdist_aaai IRE Type1 697 - 1019 0 None None Epidermal growth factor receptor
TYR EGFR EGFR_HUMAN 4WKQA 1.85 Active DFGin‑BLAminus in-in in-in TYR APEdihe_iiiai APEdist_aaai IRE Type1 696 - 1020 0 None None Epidermal growth factor receptor
TYR EGFR EGFR_HUMAN 2ITOA 3.25 None DFGin‑BLAminus in-in in-none TYR APEdihe_nniai APEdist_aaai IRE Type1 696 - 1019 0 None G719S Epidermal growth factor receptor
TYR EGFR EGFR_HUMAN 2ITZA 2.8 Inactive DFGin‑BLAminus in-out in-none TYR APEdihe_nniai APEdist_aaai IRE Type1 697 - 1020 0 None L858R Epidermal growth factor receptor
TYR EGFR EGFR_HUMAN 4I22A 1.71 Inactive DFGin‑BLBtrans out-out out-out TYR APEdihe_nniai APEdist_aaao IRE Type1 700 - 1014 0 None T790M,L858R,V948R Epidermal growth factor receptor

Ligand: IRE (Gefitinib)

Total number of chains: 11
Active chains: 1
Total number of genes: 3
Spatial label Dihedral label Number of Chains Percent Representative
DFGin BLAminus 5 45.5% 4WKQA
DFGin ABAminus 3 27.3% 5Y7ZA
DFGinter None 2 18.2% 9D5HA
DFGin BLBtrans 1 9.1% 4I22A
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
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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
OTHER GAK GAK_HUMAN 5Y7ZA 2.804 Inactive DFGin‑ABAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii IRE Type1 25 - 335 0 None None Cyclin-G-associated kinase Homo sapiens
OTHER GAK GAK_HUMAN 5Y7ZB 2.804 Inactive DFGin‑ABAminus in-in in-in nonTYR APEdihe_aaiii APEdist_iiii IRE Type1 25 - 335 0 None None Cyclin-G-associated kinase Homo sapiens
OTHER GAK GAK_HUMAN 5Y80A 2.5 Inactive DFGin‑ABAminus in-in in-out nonTYR APEdihe_aaiii APEdist_oioo IRE, IRE Type1, Allosteric 25 - 332 0 None None Cyclin-G-associated kinase Homo sapiens
TKL ILK ILK_HUMAN 9D5HA 1.5 Pseudo DFGinter‑None out-out out-out nonTYR APEdihe_aaini APEdist_oooo IRE Type1 182 - 452 0 None C346S,R371Q,C422S Scaffold protein ILK Homo sapiens
TKL ILK ILK_HUMAN 9D5EA 1.5 Pseudo DFGinter‑None out-out out-out nonTYR APEdihe_aaini APEdist_oioo IRE, IRE Type1, Type1 182 - 452 0 None C346S,C422S Scaffold protein ILK Homo sapiens
TYR EGFR EGFR_HUMAN 3UG2A 2.5 Inactive DFGin‑BLAminus in-out in-in TYR APEdihe_iiiai APEdist_aaai IRE Type1 697 - 1018 0 None G719S,T790M Epidermal growth factor receptor Homo sapiens
TYR EGFR EGFR_HUMAN 2ITYA 3.42 None DFGin‑BLAminus in-in in-none TYR APEdihe_nniai APEdist_aaai IRE Type1 697 - 1019 0 None None Epidermal growth factor receptor Homo sapiens
TYR EGFR EGFR_HUMAN 4WKQA 1.85 Active DFGin‑BLAminus in-in in-in TYR APEdihe_iiiai APEdist_aaai IRE Type1 696 - 1020 0 None None Epidermal growth factor receptor Homo sapiens
TYR EGFR EGFR_HUMAN 2ITOA 3.25 None DFGin‑BLAminus in-in in-none TYR APEdihe_nniai APEdist_aaai IRE Type1 696 - 1019 0 None G719S Epidermal growth factor receptor Homo sapiens
TYR EGFR EGFR_HUMAN 2ITZA 2.8 Inactive DFGin‑BLAminus in-out in-none TYR APEdihe_nniai APEdist_aaai IRE Type1 697 - 1020 0 None L858R Epidermal growth factor receptor Homo sapiens
TYR EGFR EGFR_HUMAN 4I22A 1.71 Inactive DFGin‑BLBtrans out-out out-out TYR APEdihe_nniai APEdist_aaao IRE Type1 700 - 1014 0 None T790M,L858R,V948R Epidermal growth factor receptor Homo sapiens

Ligand: IRE (Gefitinib)

Total number of chains: 0
Active chains: 0
Total number of genes: 0
Spatial label Dihedral label Number of Chains Percent Representative
All chains
Pymol session (all) Pymol script (all)
Representatives
Pymol session (repr) Pymol script (repr)
All chains - renumbered by
Uniprot PDB Alignment
Download database table as tsv Go to Advanced Page
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