Ligand: 0LI (Ponatinib)

Total number of chains: 25
Active chains: 0
Total number of genes: 11
Spatial label Dihedral label Number of Chains Percent Representative
DFGout BBAminus 14 56.0% 8S17A
DFGout None 9 36.0% 4QRCA
None None 2 8.0% 6TU9A
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
STE MAP3K2 M3K2_HUMAN 9P6AA 2.4 Inactive DFGout‑BBAminus in-in none-out nonTYR APEdihe_aaioi APEdist_oooo 0LI Type2 351 - 617 0 None None Mitogen-activated protein kinase kinase kinase 2
STE MAP3K2 M3K2_HUMAN 9P6AB 2.4 Inactive DFGout‑None in-in none-out nonTYR APEdihe_aaioi APEdist_nnoo 0LI Type2 347 - 618 0 None None Mitogen-activated protein kinase kinase kinase 2
TKL BRAF BRAF_HUMAN 6P3DA 2.11 Inactive DFGout‑BBAminus in-in out-out nonTYR APEdihe_aaooi APEdist_nnoo 0LI Type2 448 - 721 0 None None Serine/threonine-protein kinase B-raf
TKL IRAK4 IRAK4_HUMAN 6EG9A 2.414 Inactive DFGout‑None in-out none-none nonTYR APEdihe_aaiii APEdist_nnni 0LI Type2 164 - 459 0 None None Interleukin-1 receptor-associated kinase 4
TKL IRAK4 IRAK4_HUMAN 6EG9B 2.414 Inactive DFGout‑None in-in none-none nonTYR APEdihe_aaiii APEdist_nnni 0LI Type2 165 - 459 0 None None Interleukin-1 receptor-associated kinase 4
TKL LRRK2 LRRK2_HUMAN 8U8AB 3.4 Inactive DFGout‑BBAminus in-out none-out nonTYR APEdihe_aaiii APEdist_nnno 0LI Type2 558 - 2526 0 None None Leucine-rich repeat serine/threonine-protein kinase 2
TKL LRRK2 LRRK2_HUMAN 8U8AC 3.4 Inactive DFGout‑BBAminus in-out none-out nonTYR APEdihe_aaiii APEdist_nnno 0LI Type2 558 - 2526 0 None None Leucine-rich repeat serine/threonine-protein kinase 2
TKL RIPK2 RIPK2_HUMAN 4C8BA 2.75 Inactive DFGout‑None in-in none-out nonTYR APEdihe_aaoni APEdist_nnno 0LI Type2 8 - 316 0 None None Receptor-interacting serine/threonine-protein kinase 2
TKL RIPK2 RIPK2_HUMAN 4C8BB 2.75 Inactive DFGout‑None in-in none-out nonTYR APEdihe_aaooi APEdist_nnno 0LI Type2 9 - 316 0 None None Receptor-interacting serine/threonine-protein kinase 2
TYR DDR1 DDR1_HUMAN 3ZOSB 1.92 Inactive DFGout‑BBAminus in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI Type2 601 - 913 0 None None Epithelial discoidin domain-containing receptor 1
TYR DDR1 DDR1_HUMAN 3ZOSA 1.92 Inactive DFGout‑BBAminus in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI, 0LI Type2, Allosteric 602 - 913 0 None None Epithelial discoidin domain-containing receptor 1
TYR FGFR1 FGFR1_HUMAN 4V04B 2.12 Inactive DFGout‑BBAminus in-in none-out TYR APEdihe_iioai APEdist_aaao 0LI Type2 458 - 765 0 None C488A,C584S Fibroblast growth factor receptor 1
TYR FGFR1 FGFR1_HUMAN 4V01A 2.33 Inactive DFGout‑None in-in none-out TYR APEdihe_iioai APEdist_aaao 0LI Type2 465 - 765 0 None C488A,C584S Fibroblast growth factor receptor 1
TYR FGFR1 FGFR1_HUMAN 4V01B 2.33 Inactive DFGout‑None in-in none-out TYR APEdihe_iioai APEdist_aaao 0LI Type2 461 - 763 0 None C488A,C584S Fibroblast growth factor receptor 1
TYR FGFR1 FGFR1_HUMAN 4V04A 2.12 Inactive DFGout‑None in-in none-out TYR APEdihe_iioai APEdist_aaao 0LI Type2 463 - 765 0 None C488A,C584S Fibroblast growth factor receptor 1
TYR FGFR4 FGFR4_HUMAN 4UXQA 1.85 Inactive DFGout‑BBAminus in-in out-out TYR APEdihe_iioai APEdist_aaao 0LI Type2 452 - 750 0 None C477A Fibroblast growth factor receptor 4
TYR FGFR4 FGFR4_HUMAN 4TYJA 2.45 Inactive DFGout‑BBAminus in-in out-out TYR APEdihe_nniai APEdist_aaao 0LI Type2 447 - 753 0 None None Fibroblast growth factor receptor 4
TYR FGFR4 FGFR4_HUMAN 4QRCA 1.901 Inactive DFGout‑None in-in out-out TYR APEdihe_iioai APEdist_aaao 0LI Type2 454 - 750 0 None C477A,R664E Fibroblast growth factor receptor 4
TYR KIT KIT_HUMAN 8S17A 2.2 Inactive DFGout‑BBAminus in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI Type2 567 - 931 0 None I563S,V569S,Y609Q,L631S,M651E,I662H,D768H,R804N,V825D,C844S,L890S,H894Y,L912D,L923D Mast/stem cell growth factor receptor Kit
TYR KIT KIT_HUMAN 8S17B 2.2 Inactive DFGout‑BBAminus in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI Type2 578 - 931 0 None I563S,V569S,Y609Q,L631S,M651E,I662H,D768H,R804N,V825D,C844S,L890S,H894Y,L912D,L923D Mast/stem cell growth factor receptor Kit
TYR KIT KIT_HUMAN 4U0IA 2.0 Inactive DFGout‑BBAminus in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI Type2 565 - 933 0 None None Mast/stem cell growth factor receptor Kit
TYR ROR1 ROR1_HUMAN 6TU9A 1.94 Pseudo None‑None in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI Type1 460 - 749 0 None None Inactive tyrosine-protein kinase transmembrane receptor ROR1
TYR ROR1 ROR1_HUMAN 6TU9B 1.94 Pseudo None‑None in-in none-in TYR APEdihe_iiiai APEdist_aaai 0LI Type1 465 - 750 0 None None Inactive tyrosine-protein kinase transmembrane receptor ROR1
TYR SRC SRC_HUMAN 7OTEA 2.49 Inactive DFGout‑BBAminus in-in none-out TYR APEdihe_nniai APEdist_aaao 0LI Type2 261 - 536 0 None None Proto-oncogene tyrosine-protein kinase Src
TYR SRC SRC_HUMAN 7OTEB 2.49 Inactive DFGout‑BBAminus in-out none-out TYR APEdihe_nniai APEdist_aaao 0LI Type2 261 - 536 0 None None Proto-oncogene tyrosine-protein kinase Src

Ligand: 0LI (Ponatinib)

Total number of chains: 30
Active chains: 0
Total number of genes: 12
Spatial label Dihedral label Number of Chains Percent Representative
DFGout BBAminus 19 63.3% 3IK3B
DFGout None 9 30.0% 4QRCA
None None 2 6.7% 6TU9A
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
TYR SRC SRC_CHICK 7WF5A 1.798 Inactive DFGout‑BBAminus in-in none-out TYR APEdihe_nniai APEdist_aaao 0LI Type2 257 - 533 0 None None Proto-oncogene tyrosine-protein kinase Src Gallus gallus
TYR SRC SRC_CHICK 7WF5B 1.798 Inactive DFGout‑BBAminus in-in none-out TYR APEdihe_nniai APEdist_aaao 0LI Type2 254 - 533 0 None None Proto-oncogene tyrosine-protein kinase Src Gallus gallus
STE MAP3K2 M3K2_HUMAN 9P6AA 2.4 Inactive DFGout‑BBAminus in-in none-out nonTYR APEdihe_aaioi APEdist_oooo 0LI Type2 351 - 617 0 None None Mitogen-activated protein kinase kinase kinase 2 Homo sapiens
STE MAP3K2 M3K2_HUMAN 9P6AB 2.4 Inactive DFGout‑None in-in none-out nonTYR APEdihe_aaioi APEdist_nnoo 0LI Type2 347 - 618 0 None None Mitogen-activated protein kinase kinase kinase 2 Homo sapiens
TKL BRAF BRAF_HUMAN 6P3DA 2.11 Inactive DFGout‑BBAminus in-in out-out nonTYR APEdihe_aaooi APEdist_nnoo 0LI Type2 448 - 721 0 None None Serine/threonine-protein kinase B-raf Homo sapiens
TKL IRAK4 IRAK4_HUMAN 6EG9A 2.414 Inactive DFGout‑None in-out none-none nonTYR APEdihe_aaiii APEdist_nnni 0LI Type2 164 - 459 0 None None Interleukin-1 receptor-associated kinase 4 Homo sapiens
TKL IRAK4 IRAK4_HUMAN 6EG9B 2.414 Inactive DFGout‑None in-in none-none nonTYR APEdihe_aaiii APEdist_nnni 0LI Type2 165 - 459 0 None None Interleukin-1 receptor-associated kinase 4 Homo sapiens
TKL LRRK2 LRRK2_HUMAN 8U8AB 3.4 Inactive DFGout‑BBAminus in-out none-out nonTYR APEdihe_aaiii APEdist_nnno 0LI Type2 558 - 2526 0 None None Leucine-rich repeat serine/threonine-protein kinase 2 Homo sapiens
TKL LRRK2 LRRK2_HUMAN 8U8AC 3.4 Inactive DFGout‑BBAminus in-out none-out nonTYR APEdihe_aaiii APEdist_nnno 0LI Type2 558 - 2526 0 None None Leucine-rich repeat serine/threonine-protein kinase 2 Homo sapiens
TKL RIPK2 RIPK2_HUMAN 4C8BA 2.75 Inactive DFGout‑None in-in none-out nonTYR APEdihe_aaoni APEdist_nnno 0LI Type2 8 - 316 0 None None Receptor-interacting serine/threonine-protein kinase 2 Homo sapiens
TKL RIPK2 RIPK2_HUMAN 4C8BB 2.75 Inactive DFGout‑None in-in none-out nonTYR APEdihe_aaooi APEdist_nnno 0LI Type2 9 - 316 0 None None Receptor-interacting serine/threonine-protein kinase 2 Homo sapiens
TYR DDR1 DDR1_HUMAN 3ZOSB 1.92 Inactive DFGout‑BBAminus in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI Type2 601 - 913 0 None None Epithelial discoidin domain-containing receptor 1 Homo sapiens
TYR DDR1 DDR1_HUMAN 3ZOSA 1.92 Inactive DFGout‑BBAminus in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI, 0LI Type2, Allosteric 602 - 913 0 None None Epithelial discoidin domain-containing receptor 1 Homo sapiens
TYR FGFR1 FGFR1_HUMAN 4V04B 2.12 Inactive DFGout‑BBAminus in-in none-out TYR APEdihe_iioai APEdist_aaao 0LI Type2 458 - 765 0 None C488A,C584S Fibroblast growth factor receptor 1 Homo sapiens
TYR FGFR1 FGFR1_HUMAN 4V01A 2.33 Inactive DFGout‑None in-in none-out TYR APEdihe_iioai APEdist_aaao 0LI Type2 465 - 765 0 None C488A,C584S Fibroblast growth factor receptor 1 Homo sapiens
TYR FGFR1 FGFR1_HUMAN 4V01B 2.33 Inactive DFGout‑None in-in none-out TYR APEdihe_iioai APEdist_aaao 0LI Type2 461 - 763 0 None C488A,C584S Fibroblast growth factor receptor 1 Homo sapiens
TYR FGFR1 FGFR1_HUMAN 4V04A 2.12 Inactive DFGout‑None in-in none-out TYR APEdihe_iioai APEdist_aaao 0LI Type2 463 - 765 0 None C488A,C584S Fibroblast growth factor receptor 1 Homo sapiens
TYR FGFR4 FGFR4_HUMAN 4UXQA 1.85 Inactive DFGout‑BBAminus in-in out-out TYR APEdihe_iioai APEdist_aaao 0LI Type2 452 - 750 0 None C477A Fibroblast growth factor receptor 4 Homo sapiens
TYR FGFR4 FGFR4_HUMAN 4TYJA 2.45 Inactive DFGout‑BBAminus in-in out-out TYR APEdihe_nniai APEdist_aaao 0LI Type2 447 - 753 0 None None Fibroblast growth factor receptor 4 Homo sapiens
TYR FGFR4 FGFR4_HUMAN 4QRCA 1.901 Inactive DFGout‑None in-in out-out TYR APEdihe_iioai APEdist_aaao 0LI Type2 454 - 750 0 None C477A,R664E Fibroblast growth factor receptor 4 Homo sapiens
TYR KIT KIT_HUMAN 8S17A 2.2 Inactive DFGout‑BBAminus in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI Type2 567 - 931 0 None I563S,V569S,Y609Q,L631S,M651E,I662H,D768H,R804N,V825D,C844S,L890S,H894Y,L912D,L923D Mast/stem cell growth factor receptor Kit Homo sapiens
TYR KIT KIT_HUMAN 8S17B 2.2 Inactive DFGout‑BBAminus in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI Type2 578 - 931 0 None I563S,V569S,Y609Q,L631S,M651E,I662H,D768H,R804N,V825D,C844S,L890S,H894Y,L912D,L923D Mast/stem cell growth factor receptor Kit Homo sapiens
TYR KIT KIT_HUMAN 4U0IA 2.0 Inactive DFGout‑BBAminus in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI Type2 565 - 933 0 None None Mast/stem cell growth factor receptor Kit Homo sapiens
TYR ROR1 ROR1_HUMAN 6TU9A 1.94 Pseudo None‑None in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI Type1 460 - 749 0 None None Inactive tyrosine-protein kinase transmembrane receptor ROR1 Homo sapiens
TYR ROR1 ROR1_HUMAN 6TU9B 1.94 Pseudo None‑None in-in none-in TYR APEdihe_iiiai APEdist_aaai 0LI Type1 465 - 750 0 None None Inactive tyrosine-protein kinase transmembrane receptor ROR1 Homo sapiens
TYR SRC SRC_HUMAN 7OTEA 2.49 Inactive DFGout‑BBAminus in-in none-out TYR APEdihe_nniai APEdist_aaao 0LI Type2 261 - 536 0 None None Proto-oncogene tyrosine-protein kinase Src Homo sapiens
TYR SRC SRC_HUMAN 7OTEB 2.49 Inactive DFGout‑BBAminus in-out none-out TYR APEdihe_nniai APEdist_aaao 0LI Type2 261 - 536 0 None None Proto-oncogene tyrosine-protein kinase Src Homo sapiens
TYR ABL1 ABL1_MOUSE 3IK3A 1.9 Inactive DFGout‑BBAminus in-in none-in TYR APEdihe_iiiai APEdist_aaai 0LI Type2 229 - 513 0 None T315I Tyrosine-protein kinase ABL1 Mus musculus
TYR ABL1 ABL1_MOUSE 3IK3B 1.9 Inactive DFGout‑BBAminus in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI Type2 229 - 513 0 None T315I Tyrosine-protein kinase ABL1 Mus musculus
TYR ABL1 ABL1_MOUSE 3OXZA 2.2 Inactive DFGout‑BBAminus in-in none-out TYR APEdihe_iiiai APEdist_aaao 0LI Type2 229 - 511 0 None None Tyrosine-protein kinase ABL1 Mus musculus

Ligand: 0LI (Ponatinib)

Total number of chains: 5
Active chains: 0
Total number of genes: 2
Spatial label Dihedral label Number of Chains Percent Representative
DFGout BBAminus 5 100.0% 3IK3B
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
TYR SRC SRC_CHICK 7WF5A 1.798 Inactive DFGout‑BBAminus in-in none-out TYR APEdihe_nniai APEdist_aaao 0LI Type2 257 - 533 0 None None Proto-oncogene tyrosine-protein kinase Src Gallus gallus
TYR SRC SRC_CHICK 7WF5B 1.798 Inactive DFGout‑BBAminus in-in none-out TYR APEdihe_nniai APEdist_aaao 0LI Type2 254 - 533 0 None None Proto-oncogene tyrosine-protein kinase Src Gallus gallus
TYR ABL1 ABL1_MOUSE 3IK3A 1.9 Inactive DFGout‑BBAminus in-in none-in TYR APEdihe_iiiai APEdist_aaai 0LI Type2 229 - 513 0 None T315I Tyrosine-protein kinase ABL1 Mus musculus
TYR ABL1 ABL1_MOUSE 3IK3B 1.9 Inactive DFGout‑BBAminus in-in out-in TYR APEdihe_iiiai APEdist_aaai 0LI Type2 229 - 513 0 None T315I Tyrosine-protein kinase ABL1 Mus musculus
TYR ABL1 ABL1_MOUSE 3OXZA 2.2 Inactive DFGout‑BBAminus in-in none-out TYR APEdihe_iiiai APEdist_aaao 0LI Type2 229 - 511 0 None None Tyrosine-protein kinase ABL1 Mus musculus