PDB-code
| More entries for 5H2U | |||||
| 5H2U | Alternative model: | A | Chain: | A | |
| 5H2U | Alternative model: | A | Chain: | B | |
| 5H2U | Alternative model: | A | Chain: | C | |
| 5H2U | Alternative model: | A | Chain: | D | |
| 5H2U | Alternative model: | B | Chain: | B | |
| 5H2U | Alternative model: | B | Chain: | C | |
| 5H2U | Alternative model: | B | Chain: | D | |
| Structural information | |
| DFG conformation: | in |
| αC-helix conformation: | out |
| G-rich loop angle (distance): | 48° (15Å) |
| G-rich loop rotation: | 67.1° |
| Quality Score: | 7.6 |
| Resolution: | 2.24 Å |
| Missing Residues: | 1 |
| Missing Atoms: | 0 |
| Ligand binding mode | ||||
| Pockets | Subpockets | Waters | ||
| front gate | BP-I-B | Cluster I1 I2 I3 I4 I5 | Ligand Yes No Yes No No | Protein Yes Yes Yes Yes Yes |
| Pocket alignment | |
| Uniprot sequence: | RKLGSGYFGEVFEVAIKVIMLQSEIQAMKKLRKHILALYAVYIITELMAKGSLLELLRDYLESQNYIHRDLAARNILVVGDFGLA |
| Sequence structure: | RKLGSGYFGEVFEVAIKVIMLQSEIQAMKKLRKHILALYAVYIITELMAKGSLLELLR_YLESQNYIHRDLAARNILVVGDFGLA |
| Ligand affinity | |
| ChEMBL ID: | CHEMBL1421 |
| Bioaffinities: | 404 records for 131 kinases |
| Species | Kinase (ChEMBL naming) | Median | Min | Max | Type | Records |
|---|---|---|---|---|---|---|
| Homo sapiens | Activin receptor type-1 | 6.2 | 6.2 | 6.2 | pKd | 2 |
| Homo sapiens | Activin receptor type-1 | 7.1 | 7.1 | 7.1 | pKi | 1 |
| Homo sapiens | Activin receptor type-1B | 6.5 | 6.5 | 6.5 | pKd | 2 |
| Homo sapiens | Activin receptor type-2A | 6.7 | 6.7 | 6.7 | pKd | 2 |
| Homo sapiens | Activin receptor type-2B | 6.2 | 6.2 | 6.2 | pKd | 2 |
| Homo sapiens | Bone morphogenetic protein receptor type-1A | 5.2 | 5.2 | 5.2 | pKd | 1 |
| Homo sapiens | Bone morphogenetic protein receptor type-1B | 7.3 | 7.3 | 7.3 | pKd | 1 |
| Plasmodium falciparum (isolate 3D7) | Calcium-dependent protein kinase 1 | 6.2 | 6.2 | 6.2 | pKd | 1 |
| Homo sapiens | Casein kinase I epsilon | 5.8 | 5.8 | 5.8 | pKd | 2 |
| Homo sapiens | Chaperone activity of bc1 complex-like, mitochondrial | 6.7 | 6.7 | 6.7 | pKd | 2 |
| Homo sapiens | Discoidin domain-containing receptor 2 | 8.7 | 6.1 | 9.4 | pIC50 | 5 |
| Homo sapiens | Discoidin domain-containing receptor 2 | 8.5 | 7.8 | 8.5 | pKd | 4 |
| Homo sapiens | Dual specificity mitogen-activated protein kinase kinase 1 | 6 | 6 | 6 | pKd | 2 |
| Homo sapiens | Dual specificity mitogen-activated protein kinase kinase 1 | 6.2 | 6.2 | 6.2 | pKi | 1 |
| Homo sapiens | Dual specificity mitogen-activated protein kinase kinase 2 | 5.9 | 5.9 | 5.9 | pKd | 2 |
| Homo sapiens | Dual specificity mitogen-activated protein kinase kinase 2 | 5.8 | 5.8 | 5.8 | pKi | 1 |
| Homo sapiens | Dual specificity mitogen-activated protein kinase kinase 5 | 8.5 | 8.5 | 8.5 | pKd | 1 |
| Homo sapiens | Dual specificity testis-specific protein kinase 1 | 7.5 | 7.5 | 7.5 | pKd | 2 |
| Homo sapiens | Dual-specificity tyrosine-phosphorylation regulated kinase 3 | 5.9 | 5.9 | 5.9 | pKi | 1 |
| Homo sapiens | Ephrin type-A receptor 1 | 8.4 | 8.4 | 8.4 | pKd | 2 |
| Homo sapiens | Ephrin type-A receptor 2 | 6.9 | 6.9 | 6.9 | pIC50 | 1 |
| Homo sapiens | Ephrin type-A receptor 2 | 9.1 | 9.1 | 9.1 | pKd | 2 |
| Homo sapiens | Ephrin type-A receptor 2 | 8.4 | 8.4 | 8.4 | pKi | 1 |
| Homo sapiens | Ephrin type-A receptor 3 | 10 | 10 | 10 | pKd | 2 |
| Homo sapiens | Ephrin type-A receptor 4 | 8.9 | 8.9 | 8.9 | pKd | 2 |
| Homo sapiens | Ephrin type-A receptor 5 | 9.6 | 9.6 | 9.6 | pKd | 2 |
| Homo sapiens | Ephrin type-A receptor 6 | 5.7 | 5.7 | 5.7 | pKd | 1 |
| Homo sapiens | Ephrin type-A receptor 8 | 9.6 | 9.6 | 9.6 | pKd | 2 |
| Homo sapiens | Ephrin type-B receptor 1 | 9.4 | 9.4 | 9.4 | pKd | 2 |
| Homo sapiens | Ephrin type-B receptor 2 | 8.4 | 8.4 | 8.4 | pIC50 | 1 |
| Homo sapiens | Ephrin type-B receptor 2 | 9.4 | 9.4 | 9.4 | pKd | 2 |
| Homo sapiens | Ephrin type-B receptor 3 | 8.2 | 8.2 | 8.2 | pKd | 2 |
| Homo sapiens | Ephrin type-B receptor 4 | 9.5 | 9.5 | 9.5 | pKd | 2 |
| Homo sapiens | Epidermal growth factor receptor erbB1 | 6.8 | 5.5 | 7.7 | pIC50 | 5 |
| Homo sapiens | Epidermal growth factor receptor erbB1 | 6.9 | 5.6 | 7.1 | pKd | 22 |
| Homo sapiens | Epithelial discoidin domain-containing receptor 1 | 8.3 | 8.3 | 9.3 | pIC50 | 2 |
| Homo sapiens | Epithelial discoidin domain-containing receptor 1 | 9.2 | 9.2 | 9.2 | pKd | 2 |
| Homo sapiens | Eukaryotic translation initiation factor 2-alpha kinase 4 | 5.8 | 5.8 | 5.8 | pKd | 2 |
| Homo sapiens | Fibroblast growth factor receptor 1 | 6.1 | 6.1 | 6.1 | pIC50 | 1 |
| Homo sapiens | Fibroblast growth factor receptor 1 | 5.4 | 5.4 | 5.4 | pKd | 2 |
| Homo sapiens | Fibroblast growth factor receptor 1 | 5.7 | 5.7 | 5.7 | pKi | 1 |
| Homo sapiens | Fibroblast growth factor receptor 2 | 5.9 | 5.9 | 5.9 | pKd | 2 |
| Homo sapiens | Fibroblast growth factor receptor 3 | 5.4 | 5.4 | 5.4 | pKd | 1 |
| Homo sapiens | Fibroblast growth factor receptor 3 | 5.9 | 5.9 | 5.9 | pKi | 1 |
| Homo sapiens | Interleukin-1 receptor-associated kinase 4 | 5.3 | 5.3 | 5.3 | pKi | 1 |
| Homo sapiens | LIM domain kinase 1 | 6.9 | 6.9 | 6.9 | pIC50 | 1 |
| Homo sapiens | LIM domain kinase 1 | 6.2 | 6.2 | 6.2 | pKd | 2 |
| Homo sapiens | LIM domain kinase 1 | 6.6 | 6.6 | 6.6 | pKi | 1 |
| Homo sapiens | LIM domain kinase 2 | 7.1 | 7.1 | 7.1 | pKd | 2 |
| Homo sapiens | Macrophage colony stimulating factor receptor | 8.1 | 8.1 | 8.3 | pIC50 | 2 |
| Homo sapiens | Macrophage colony stimulating factor receptor | 9.2 | 9.2 | 9.2 | pKd | 2 |
| Homo sapiens | MAP kinase p38 alpha | 7.6 | 6.3 | 7.6 | pKd | 5 |
| Homo sapiens | MAP kinase p38 alpha | 7.5 | 7.5 | 7.5 | pKi | 1 |
| Homo sapiens | MAP kinase p38 beta | 6.4 | 6.4 | 6.4 | pKd | 2 |
| Homo sapiens | Misshapen-like kinase 1 | 6.4 | 6.4 | 6.4 | pKd | 1 |
| Homo sapiens | Misshapen-like kinase 1 | 6.1 | 6.1 | 6.1 | pKi | 1 |
| Homo sapiens | Mitogen-activated protein kinase kinase kinase 10 | 5.6 | 5.6 | 5.6 | pKi | 1 |
| Homo sapiens | Mitogen-activated protein kinase kinase kinase 13 | 5.3 | 5.3 | 5.3 | pKd | 1 |
| Homo sapiens | Mitogen-activated protein kinase kinase kinase 2 | 6.9 | 6.9 | 6.9 | pKd | 1 |
| Homo sapiens | Mitogen-activated protein kinase kinase kinase 3 | 6.6 | 6.6 | 6.6 | pKd | 1 |
| Homo sapiens | Mitogen-activated protein kinase kinase kinase 4 | 6.5 | 6.5 | 6.5 | pKd | 2 |
| Homo sapiens | Mitogen-activated protein kinase kinase kinase 7 | 5.4 | 5.4 | 5.4 | pKd | 1 |
| Homo sapiens | Mitogen-activated protein kinase kinase kinase kinase 1 | 6 | 6 | 6 | pKd | 2 |
| Homo sapiens | Mitogen-activated protein kinase kinase kinase kinase 2 | 5.9 | 5.9 | 5.9 | pKd | 1 |
| Homo sapiens | Mitogen-activated protein kinase kinase kinase kinase 3 | 6.2 | 6.2 | 6.2 | pKd | 2 |
| Homo sapiens | Mitogen-activated protein kinase kinase kinase kinase 4 | 5.5 | 5.5 | 5.5 | pKd | 2 |
| Homo sapiens | Mitogen-activated protein kinase kinase kinase kinase 5 | 7.4 | 7.4 | 7.4 | pKd | 2 |
| Homo sapiens | Mitogen-activated protein kinase kinase kinase kinase 5 | 7.8 | 7.8 | 7.8 | pKi | 1 |
| Homo sapiens | Mixed lineage kinase 7 | 7.4 | 7.4 | 7.4 | pKd | 2 |
| Homo sapiens | Mixed lineage kinase 7 | 7.3 | 7.3 | 7.3 | pKi | 1 |
| Homo sapiens | myosin light chain kinase 2 | 5.5 | 5.5 | 5.5 | pKd | 1 |
| Homo sapiens | Myotonin-protein kinase | 5.9 | 5.9 | 5.9 | pKd | 2 |
| Homo sapiens | Platelet-derived growth factor receptor alpha | 7.2 | 7.2 | 8 | pIC50 | 2 |
| Homo sapiens | Platelet-derived growth factor receptor alpha | 9.3 | 9.3 | 9.3 | pKd | 2 |
| Homo sapiens | Platelet-derived growth factor receptor alpha | 8 | 8 | 8 | pKi | 1 |
| Homo sapiens | Platelet-derived growth factor receptor beta | 7.6 | 7.6 | 7.6 | pIC50 | 1 |
| Homo sapiens | Platelet-derived growth factor receptor beta | 9.2 | 9.2 | 9.2 | pKd | 2 |
| Homo sapiens | Platelet-derived growth factor receptor beta | 8.9 | 8.9 | 8.9 | pKi | 1 |
| Homo sapiens | Protein kinase N2 | 5.3 | 5.3 | 5.3 | pKi | 1 |
| Homo sapiens | Receptor protein-tyrosine kinase erbB-2 | 6.2 | 6.2 | 6.2 | pIC50 | 2 |
| Homo sapiens | Receptor protein-tyrosine kinase erbB-2 | 5.9 | 5.9 | 5.9 | pKd | 2 |
| Homo sapiens | Receptor protein-tyrosine kinase erbB-2 | 6.8 | 6.8 | 6.8 | pKi | 1 |
| Homo sapiens | Receptor protein-tyrosine kinase erbB-4 | 7.3 | 7.3 | 7.3 | pKd | 1 |
| Homo sapiens | Receptor protein-tyrosine kinase erbB-4 | 7.4 | 7.4 | 7.4 | pKi | 1 |
| Homo sapiens | Receptor tyrosine-protein kinase erbB-3 | 7.8 | 7.8 | 7.8 | pKd | 1 |
| Homo sapiens | Serine/threonine-protein kinase 10 | 5.9 | 5.9 | 5.9 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase 2 | 6.1 | 6.1 | 6.1 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase 2 | 6.2 | 6.2 | 6.2 | pKi | 1 |
| Homo sapiens | Serine/threonine-protein kinase 25 | 5.5 | 5.5 | 5.5 | pKd | 1 |
| Homo sapiens | Serine/threonine-protein kinase 35 | 6.1 | 6.1 | 6.1 | pKd | 1 |
| Homo sapiens | Serine/threonine-protein kinase 36 | 6.7 | 6.7 | 6.7 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase Aurora-A | 5.6 | 5.6 | 5.6 | pIC50 | 1 |
| Homo sapiens | Serine/threonine-protein kinase Aurora-A | 5 | 5 | 5 | pKd | 1 |
| Homo sapiens | Serine/threonine-protein kinase Aurora-B | 5.2 | 5.2 | 5.2 | pIC50 | 1 |
| Homo sapiens | Serine/threonine-protein kinase Aurora-B | 5.9 | 5.9 | 5.9 | pKi | 1 |
| Homo sapiens | Serine/threonine-protein kinase B-raf | 6.2 | 6.2 | 6.3 | pKd | 4 |
| Homo sapiens | Serine/threonine-protein kinase GAK | 8.6 | 8.6 | 8.6 | pKd | 3 |
| Homo sapiens | Serine/threonine-protein kinase MRCK-A | 5.7 | 5.7 | 5.7 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase MRCK-A | 5.2 | 5.2 | 5.2 | pKi | 1 |
| Homo sapiens | Serine/threonine-protein kinase MRCK beta | 5.7 | 5.7 | 5.7 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase MRCK gamma | 5.9 | 5.9 | 5.9 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase MST1 | 5.4 | 5.4 | 5.4 | pKd | 1 |
| Homo sapiens | Serine/threonine-protein kinase MST4 | 5.7 | 5.7 | 5.7 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase mTOR | 4.5 | 4.5 | 4.5 | pIC50 | 1 |
| Homo sapiens | Serine/threonine-protein kinase Nek11 | 6.3 | 6.3 | 6.3 | pKd | 1 |
| Homo sapiens | Serine/threonine-protein kinase NEK2 | 5.2 | 5.2 | 5.2 | pKd | 1 |
| Homo sapiens | Serine/threonine protein kinase NLK | 6.6 | 6.6 | 6.6 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase PLK4 | 5.7 | 5.7 | 5.7 | pKi | 1 |
| Homo sapiens | Serine/threonine-protein kinase RAF | 6.8 | 6.8 | 6.8 | pIC50 | 1 |
| Homo sapiens | Serine/threonine-protein kinase RAF | 6.2 | 6.2 | 6.2 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase receptor R3 | 6.3 | 6.3 | 6.3 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase RIPK2 | 7 | 7 | 7 | pIC50 | 1 |
| Homo sapiens | Serine/threonine-protein kinase RIPK2 | 7.5 | 7.5 | 7.5 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase SBK1 | 5.9 | 5.9 | 5.9 | pKd | 1 |
| Homo sapiens | Serine/threonine-protein kinase SIK1 | 8.4 | 8.4 | 8.4 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase SIK2 | 8.2 | 8.2 | 8.2 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase SIK2 | 9.1 | 9.1 | 9.1 | pKi | 1 |
| Homo sapiens | Serine/threonine-protein kinase SIK3 | 7.6 | 7.6 | 7.6 | pKd | 1 |
| Homo sapiens | Serine/threonine-protein kinase TAO1 | 6 | 6 | 6 | pKi | 1 |
| Homo sapiens | Serine/threonine-protein kinase TAO2 | 5.3 | 5.3 | 5.3 | pKd | 1 |
| Homo sapiens | Serine/threonine-protein kinase TAO3 | 5.6 | 5.6 | 5.6 | pKd | 1 |
| Homo sapiens | Serine/threonine-protein kinase TNNI3K | 8 | 8 | 8 | pKd | 2 |
| Homo sapiens | Serine/threonine-protein kinase ULK3 | 5.3 | 5.3 | 5.3 | pKd | 1 |
| Homo sapiens | Serine/threonine-protein kinase WEE1 | 5.2 | 5.2 | 5.2 | pKd | 3 |
| Homo sapiens | SPS1/STE20-related protein kinase YSK4 | 7.1 | 7.1 | 7.1 | pKd | 1 |
| Homo sapiens | Stem cell growth factor receptor | 8.3 | 6.9 | 8.8 | pIC50 | 9 |
| Homo sapiens | Stem cell growth factor receptor | 9.1 | 8.6 | 9.2 | pKd | 13 |
| Homo sapiens | TGF-beta receptor type I | 6.6 | 6.6 | 6.6 | pKd | 2 |
| Homo sapiens | TGF-beta receptor type II | 5.5 | 5.5 | 5.5 | pKd | 2 |
| Homo sapiens | TRAF2- and NCK-interacting kinase | 5.7 | 5.7 | 5.7 | pKd | 2 |
| Homo sapiens | Tyrosine- and threonine-specific cdc2-inhibitory kinase | 6.7 | 6.7 | 8.2 | pIC50 | 2 |
| Homo sapiens | Tyrosine- and threonine-specific cdc2-inhibitory kinase | 6.9 | 6.8 | 6.9 | pKd | 3 |
| Homo sapiens | Tyrosine- and threonine-specific cdc2-inhibitory kinase | 7.1 | 7.1 | 9.3 | pKi | 2 |
| Homo sapiens | Tyrosine kinase non-receptor protein 2 | 8.3 | 8.2 | 8.3 | pKd | 3 |
| Homo sapiens | Tyrosine kinase non-receptor protein 2 | 8.6 | 8.6 | 8.6 | pKi | 1 |
| Homo sapiens | Tyrosine-protein kinase ABL | 8.5 | 5.8 | 9.8 | pIC50 | 14 |
| Homo sapiens | Tyrosine-protein kinase ABL | 10.2 | 6.1 | 10.8 | pKd | 22 |
| Homo sapiens | Tyrosine-protein kinase ABL2 | 9.8 | 9.8 | 9.8 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase BLK | 9.7 | 9.7 | 9.7 | pKd | 2 |
| Mus musculus | Tyrosine-protein kinase BLK | 8.1 | 8.1 | 8.1 | pIC50 | 1 |
| Homo sapiens | Tyrosine-protein kinase BMX | 8.9 | 8.9 | 8.9 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase BRK | 8.1 | 8.1 | 8.1 | pIC50 | 1 |
| Homo sapiens | Tyrosine-protein kinase BRK | 8.1 | 8.1 | 8.1 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase BRK | 8.3 | 8.3 | 8.3 | pKi | 1 |
| Homo sapiens | Tyrosine-protein kinase BTK | 8.3 | 8.3 | 8.9 | pIC50 | 3 |
| Homo sapiens | Tyrosine-protein kinase BTK | 8.9 | 8.9 | 8.9 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase CSK | 9 | 9 | 9 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase FES | 5.7 | 5.7 | 5.7 | pKi | 1 |
| Homo sapiens | Tyrosine-protein kinase FGR | 9.3 | 9.3 | 9.3 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase FRK | 9.5 | 9.5 | 9.5 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase FYN | 9.7 | 9.7 | 9.7 | pIC50 | 1 |
| Homo sapiens | Tyrosine-protein kinase FYN | 9.1 | 9.1 | 9.1 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase HCK | 9.5 | 9.5 | 9.5 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase HCK | 9.5 | 9.5 | 9.5 | pKi | 1 |
| Homo sapiens | Tyrosine-protein kinase ITK/TSK | 6.6 | 6.6 | 6.6 | pIC50 | 1 |
| Homo sapiens | Tyrosine-protein kinase JAK2 | 6 | 6 | 6 | pKd | 4 |
| Homo sapiens | Tyrosine-protein kinase JAK2 | 5.9 | 5.9 | 5.9 | pKi | 2 |
| Homo sapiens | Tyrosine-protein kinase JAK3 | 6.2 | 6.2 | 6.2 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase LCK | 8.5 | 8.4 | 9.4 | pIC50 | 4 |
| Homo sapiens | Tyrosine-protein kinase LCK | 9.7 | 9.7 | 9.7 | pKd | 2 |
| Mus musculus | Tyrosine-protein kinase LCK | 10.2 | 10.2 | 10.2 | pKi | 1 |
| Homo sapiens | Tyrosine-protein kinase Lyn | 9.2 | 9.2 | 9.2 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase receptor FLT3 | 5.2 | 5 | 5.5 | pKd | 7 |
| Homo sapiens | Tyrosine-protein kinase receptor RET | 5.7 | 5.7 | 6.4 | pIC50 | 2 |
| Homo sapiens | Tyrosine-protein kinase receptor RET | 6.1 | 5.5 | 6.4 | pKd | 5 |
| Homo sapiens | Tyrosine-protein kinase receptor UFO | 5.7 | 5.7 | 5.7 | pKi | 1 |
| Gallus gallus | Tyrosine-protein kinase SRC | 6.3 | 6.3 | 9.4 | pIC50 | 2 |
| Gallus gallus | Tyrosine-protein kinase SRC | 8 | 8 | 8 | pKd | 1 |
| Homo sapiens | Tyrosine-protein kinase SRC | 9.2 | 7.9 | 9.5 | pIC50 | 9 |
| Homo sapiens | Tyrosine-protein kinase SRC | 9.7 | 8 | 9.7 | pKd | 4 |
| Homo sapiens | Tyrosine-protein kinase Srms | 7.9 | 7.9 | 7.9 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase Srms | 9.2 | 9.2 | 9.2 | pKi | 1 |
| Homo sapiens | Tyrosine-protein kinase SYK | 5.5 | 5.5 | 5.5 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase SYK | 6.7 | 6.7 | 6.7 | pKi | 1 |
| Homo sapiens | Tyrosine-protein kinase TEC | 6.5 | 6.5 | 6.5 | pIC50 | 1 |
| Homo sapiens | Tyrosine-protein kinase TEC | 7.9 | 7.9 | 7.9 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase TXK | 9.5 | 9.5 | 9.5 | pIC50 | 1 |
| Homo sapiens | Tyrosine-protein kinase TXK | 8.7 | 8.7 | 8.7 | pKd | 2 |
| Homo sapiens | Tyrosine-protein kinase TYK2 | 5.8 | 5.8 | 7 | pKd | 4 |
| Homo sapiens | Tyrosine-protein kinase YES | 9.3 | 9.3 | 9.3 | pIC50 | 3 |
| Homo sapiens | Tyrosine-protein kinase YES | 9.5 | 9.5 | 9.5 | pKd | 2 |
| Homo sapiens | Vascular endothelial growth factor receptor 1 | 5.3 | 5.3 | 5.3 | pKd | 2 |
| Homo sapiens | Vascular endothelial growth factor receptor 2 | 5.6 | 5.6 | 5.6 | pIC50 | 1 |
| Homo sapiens | Vascular endothelial growth factor receptor 2 | 5.5 | 5.5 | 5.5 | pKd | 1 |
| Homo sapiens | Vascular endothelial growth factor receptor 2 | 5.9 | 5.9 | 5.9 | pKi | 1 |
| Homo sapiens | Wee1-like protein kinase 2 | 6.3 | 6.3 | 6.7 | pKd | 2 |
Kinase-ligand interaction pattern
• Hydrophobic • Aromatic face-to-face • Aromatic face-to-edge • H-bond donor • H-bond acceptor • Ionic positive • Ionic negative
| I | g.l | II | III | αC | |||||||||||||||
| 1 R 195 | 2 K 196 | 3 L 197 | 4 G 198 | 5 S 199 | 6 G 200 | 7 Y 201 | 8 F 202 | 9 G 203 | 10 E 204 | 11 V 205 | 12 F 206 | 13 E 207 | 14 V 216 | 15 A 217 | 16 I 218 | 17 K 219 | 18 V 220 | 19 I 221 | 20 M 231 |
| • | • | • | • | •• | |||||||||||||||
| αC | b.l | IV | |||||||||||||||||
| 21 L 232 | 22 Q 233 | 23 S 234 | 24 E 235 | 25 I 236 | 26 Q 237 | 27 A 238 | 28 M 239 | 29 K 240 | 30 K 241 | 31 L 242 | 32 R 243 | 33 K 245 | 34 H 246 | 35 I 247 | 36 L 248 | 37 A 249 | 38 L 250 | 39 Y 251 | 40 A 252 |
| • | |||||||||||||||||||
| IV | V | GK | hinge | linker | αD | αE | |||||||||||||
| 41 V 253 | 42 Y 261 | 43 I 262 | 44 I 263 | 45 T 264 | 46 E 265 | 47 L 266 | 48 M 267 | 49 A 268 | 50 K 269 | 51 G 270 | 52 S 271 | 53 L 272 | 54 L 273 | 55 E 274 | 56 L 275 | 57 L 276 | 58 R 277 | 59 _ _ | 60 Y 302 |
| • | • | •• | • | ••• | • | • | • | ||||||||||||
| αE | VI | c.l | VII | VIII | x | ||||||||||||||
| 61 L 303 | 62 E 304 | 63 S 305 | 64 Q 306 | 65 N 307 | 66 Y 308 | 67 I 309 | 68 H 310 | 69 R 311 | 70 D 312 | 71 L 313 | 72 A 314 | 73 A 315 | 74 R 316 | 75 N 317 | 76 I 318 | 77 L 319 | 78 V 320 | 79 V 328 | 80 G 329 |
| • | • | ||||||||||||||||||
| DFG | a.l | ||||||||||||||||||
| 81 D 330 | 82 F 331 | 83 G 332 | 84 L 333 | 85 A 334 | |||||||||||||||
| • | • | ||||||||||||||||||
Interaction pattern search
Search KLIFS for kinase-ligand complexes with similar interaction patterns:





