Protein kinases in complex with STI (Imatinib)

Total number of genes: 9
Total number of chains: 24
Spatial Dihedral Chains Representative
DFGin BLAminus 2 7N9GB
DFGinter None 2 7N9GA
DFGout BBAminus 19 2PL0A
DFGout None 1 3HECA
All chains
Pymol session(ver 2.3) Pymol script
All chains - renumbered by
Uniprot PDB Alignment
Database table as tsv
Group Gene UniprotID Protein PDB Resolu Activity Label Spatial Label Dihedral Label Chelix-SaltBridge ActLoopNT-ActLoopCT Ligand Type
CMGC MAPK14 MK14_HUMAN Mitogen-activated protein kinase 14 3HECA 2.5 Inactive DFGout None in-in none-out STI Type2
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 7N9GB 2.2 Active DFGin BLAminus in-in in-in STI 1N1 Allosteric Type1
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 7N9GA 2.2 Inactive DFGinter None in-out out-in STI 1N1 Allosteric Type1
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 7N9GC 2.2 Inactive DFGinter None in-none out-in STI 1N1 Allosteric Type1
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 2HYYA 2.4 Inactive DFGout BBAminus in-in out-in STI Type2
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 2HYYB 2.4 Inactive DFGout BBAminus in-in out-in STI Type2
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 2HYYC 2.4 Inactive DFGout BBAminus in-in out-in STI Type2
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 2HYYD 2.4 Inactive DFGout BBAminus in-in out-in STI Type2
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 3PYYA 1.85 Inactive DFGout BBAminus in-in out-in STI 3YY Type2 Allosteric
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 3PYYB 1.85 Inactive DFGout BBAminus in-in none-out STI 3YY Type2 Allosteric
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 6NPEA 2.15 Inactive DFGout BBAminus in-in out-in STI KWD Type2 Allosteric
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 6NPEB 2.15 Inactive DFGout BBAminus in-in none-in STI KWD Type2 Allosteric
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 6NPUA 2.33 Inactive DFGout BBAminus in-in out-in STI KWV Type2 Allosteric
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 6NPUB 2.33 Inactive DFGout BBAminus in-in none-in STI KWV Type2 Allosteric
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 6NPVA 1.86 Inactive DFGout BBAminus in-in out-in STI KWP Type2 Allosteric
TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 6NPVB 1.86 Inactive DFGout BBAminus in-in none-in STI KWP Type2 Allosteric
TYR ABL2 ABL2_HUMAN Tyrosine-protein kinase ABL2 3GVUA 2.05 Inactive DFGout BBAminus in-in out-in STI STI Type2 Allosteric
TYR CSF1R CSF1R_HUMAN Macrophage colony-stimulating factor 1 receptor 4R7IA 2.75 Inactive DFGout BBAminus in-in out-in STI Type2
TYR DDR1 DDR1_HUMAN Epithelial discoidin domain-containing receptor 1 4BKJA 1.7 Inactive DFGout BBAminus in-in out-in STI Type2
TYR DDR1 DDR1_HUMAN Epithelial discoidin domain-containing receptor 1 4BKJB 1.7 Inactive DFGout BBAminus in-in out-in STI Type2
TYR KIT KIT_HUMAN Mast/stem cell growth factor receptor Kit 1T46A 1.6 Inactive DFGout BBAminus in-in out-in STI Type2
TYR LCK LCK_HUMAN Tyrosine-protein kinase Lck 2PL0A 2.8 Inactive DFGout BBAminus in-in out-in STI Type2
TYR PDGFRA PGFRA_HUMAN Platelet-derived growth factor receptor alpha 6JOLA 1.9 Inactive DFGout BBAminus in-in out-in STI Type2
TYR SYK KSYK_HUMAN Tyrosine-protein kinase SYK 1XBBA 1.57 Active DFGin BLAminus in-in in-in STI Type1

Protein kinases in complex with STI

Total number of genes: 10
Total number of chains: 43
Spatial Dihedral Chains Representative
DFGin BLAminus 2 7N9GB
DFGinter None 2 7N9GA
DFGout BBAminus 38 1OPJA
DFGout None 1 3HECA
All chains
Pymol session(ver 2.3) Pymol script
All chains - renumbered by
Uniprot PDB Alignment
Database table as tsv
Organism Group Gene UniprotID Protein PDB Resolu Activity Label Spatial Label Dihedral Label Chelix-SaltBridge ActLoopNT-ActLoopCT Ligand Type
Gallus gallus TYR SRC SRC_CHICK Proto-oncogene tyrosine-protein kinase Src 3OEZA 2.4 Inactive DFGout BBAminus in-in none-out STI Type2
Gallus gallus TYR SRC SRC_CHICK Proto-oncogene tyrosine-protein kinase Src 3OEZB 2.4 Inactive DFGout BBAminus in-out none-out STI Type2
Gallus gallus TYR SRC SRC_CHICK Proto-oncogene tyrosine-protein kinase Src 2OIQA 2.07 Inactive DFGout BBAminus in-in none-out STI Type2
Homo sapiens CMGC MAPK14 MK14_HUMAN Mitogen-activated protein kinase 14 3HECA 2.5 Inactive DFGout None in-in none-out STI Type2
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 7N9GB 2.2 Active DFGin BLAminus in-in in-in STI 1N1 Allosteric Type1
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 7N9GA 2.2 Inactive DFGinter None in-out out-in STI 1N1 Allosteric Type1
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 7N9GC 2.2 Inactive DFGinter None in-none out-in STI 1N1 Allosteric Type1
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 2HYYA 2.4 Inactive DFGout BBAminus in-in out-in STI Type2
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 2HYYB 2.4 Inactive DFGout BBAminus in-in out-in STI Type2
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 2HYYC 2.4 Inactive DFGout BBAminus in-in out-in STI Type2
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 2HYYD 2.4 Inactive DFGout BBAminus in-in out-in STI Type2
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 3PYYA 1.85 Inactive DFGout BBAminus in-in out-in STI 3YY Type2 Allosteric
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 3PYYB 1.85 Inactive DFGout BBAminus in-in none-out STI 3YY Type2 Allosteric
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 6NPEA 2.15 Inactive DFGout BBAminus in-in out-in STI KWD Type2 Allosteric
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 6NPEB 2.15 Inactive DFGout BBAminus in-in none-in STI KWD Type2 Allosteric
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 6NPUA 2.33 Inactive DFGout BBAminus in-in out-in STI KWV Type2 Allosteric
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 6NPUB 2.33 Inactive DFGout BBAminus in-in none-in STI KWV Type2 Allosteric
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 6NPVA 1.86 Inactive DFGout BBAminus in-in out-in STI KWP Type2 Allosteric
Homo sapiens TYR ABL1 ABL1_HUMAN Tyrosine-protein kinase ABL1 6NPVB 1.86 Inactive DFGout BBAminus in-in none-in STI KWP Type2 Allosteric
Homo sapiens TYR ABL2 ABL2_HUMAN Tyrosine-protein kinase ABL2 3GVUA 2.05 Inactive DFGout BBAminus in-in out-in STI STI Type2 Allosteric
Homo sapiens TYR CSF1R CSF1R_HUMAN Macrophage colony-stimulating factor 1 receptor 4R7IA 2.75 Inactive DFGout BBAminus in-in out-in STI Type2
Homo sapiens TYR DDR1 DDR1_HUMAN Epithelial discoidin domain-containing receptor 1 4BKJA 1.7 Inactive DFGout BBAminus in-in out-in STI Type2
Homo sapiens TYR DDR1 DDR1_HUMAN Epithelial discoidin domain-containing receptor 1 4BKJB 1.7 Inactive DFGout BBAminus in-in out-in STI Type2
Homo sapiens TYR KIT KIT_HUMAN Mast/stem cell growth factor receptor Kit 1T46A 1.6 Inactive DFGout BBAminus in-in out-in STI Type2
Homo sapiens TYR LCK LCK_HUMAN Tyrosine-protein kinase Lck 2PL0A 2.8 Inactive DFGout BBAminus in-in out-in STI Type2
Homo sapiens TYR PDGFRA PGFRA_HUMAN Platelet-derived growth factor receptor alpha 6JOLA 1.9 Inactive DFGout BBAminus in-in out-in STI Type2
Homo sapiens TYR SYK KSYK_HUMAN Tyrosine-protein kinase SYK 1XBBA 1.57 Active DFGin BLAminus in-in in-in STI Type1
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3K5VA 1.74 Inactive DFGout BBAminus in-in out-in STJ STI Allosteric Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3K5VB 1.74 Inactive DFGout BBAminus in-in out-in STJ STI Allosteric Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 6HD4A 2.03 Inactive DFGout BBAminus in-in out-in FYW STI Allosteric Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 6HD4B 2.03 Inactive DFGout BBAminus in-in out-in FYW STI Allosteric Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 6HD6A 2.3 Inactive DFGout BBAminus in-in out-in FYH STI Allosteric Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 1IEPA 2.1 Inactive DFGout BBAminus in-in out-in STI Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 1IEPB 2.1 Inactive DFGout BBAminus in-out out-in STI Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 1OPJA 1.75 Inactive DFGout BBAminus in-in out-out STI Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 1OPJB 1.75 Inactive DFGout BBAminus in-in out-in STI Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 6HD6B 2.3 Inactive DFGout BBAminus in-in out-in STI Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3MS9A 1.8 Inactive DFGout BBAminus in-in out-in STI MS9 Type2 Allosteric
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3MS9B 1.8 Inactive DFGout BBAminus in-in out-in STI MS9 Type2 Allosteric
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3MSSA 1.95 Inactive DFGout BBAminus in-in out-in STI MS7 Type2 Allosteric
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3MSSB 1.95 Inactive DFGout BBAminus in-in out-in STI MS7 Type2 Allosteric
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3MSSC 1.95 Inactive DFGout BBAminus in-in out-in STI MS7 Type2 Allosteric
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3MSSD 1.95 Inactive DFGout BBAminus in-in out-in STI MS7 Type2 Allosteric

Protein kinases in complex with STI

Total number of genes: 2
Total number of chains: 19
Spatial Dihedral Chains Representative
DFGout BBAminus 19 1OPJA
All chains
Pymol session(ver 2.3) Pymol script
All chains - renumbered by
Uniprot PDB Alignment
Database table as tsv

Organism Group Gene UniprotID Protein PDB Resolu Activity Label Spatial Label Dihedral Label Chelix-SaltBridge ActLoopNT-ActLoopCT Ligand Type
Gallus gallus TYR SRC SRC_CHICK Proto-oncogene tyrosine-protein kinase Src 3OEZA 2.4 Inactive DFGout BBAminus in-in none-out STI Type2
Gallus gallus TYR SRC SRC_CHICK Proto-oncogene tyrosine-protein kinase Src 3OEZB 2.4 Inactive DFGout BBAminus in-out none-out STI Type2
Gallus gallus TYR SRC SRC_CHICK Proto-oncogene tyrosine-protein kinase Src 2OIQA 2.07 Inactive DFGout BBAminus in-in none-out STI Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3K5VA 1.74 Inactive DFGout BBAminus in-in out-in STJ STI Allosteric Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3K5VB 1.74 Inactive DFGout BBAminus in-in out-in STJ STI Allosteric Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 6HD4A 2.03 Inactive DFGout BBAminus in-in out-in FYW STI Allosteric Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 6HD4B 2.03 Inactive DFGout BBAminus in-in out-in FYW STI Allosteric Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 6HD6A 2.3 Inactive DFGout BBAminus in-in out-in FYH STI Allosteric Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 1IEPA 2.1 Inactive DFGout BBAminus in-in out-in STI Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 1IEPB 2.1 Inactive DFGout BBAminus in-out out-in STI Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 1OPJA 1.75 Inactive DFGout BBAminus in-in out-out STI Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 1OPJB 1.75 Inactive DFGout BBAminus in-in out-in STI Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 6HD6B 2.3 Inactive DFGout BBAminus in-in out-in STI Type2
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3MS9A 1.8 Inactive DFGout BBAminus in-in out-in STI MS9 Type2 Allosteric
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3MS9B 1.8 Inactive DFGout BBAminus in-in out-in STI MS9 Type2 Allosteric
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3MSSA 1.95 Inactive DFGout BBAminus in-in out-in STI MS7 Type2 Allosteric
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3MSSB 1.95 Inactive DFGout BBAminus in-in out-in STI MS7 Type2 Allosteric
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3MSSC 1.95 Inactive DFGout BBAminus in-in out-in STI MS7 Type2 Allosteric
Mus musculus TYR ABL1 ABL1_MOUSE Tyrosine-protein kinase ABL1 3MSSD 1.95 Inactive DFGout BBAminus in-in out-in STI MS7 Type2 Allosteric