7DXL
Fragment-based Lead Discovery of Indazole-based Compounds as AXL Kinase Inhibitors
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B | Tyrosine-protein kinase Mer | polymer | 296 | 34048.4 | 2 | UniProt (Q12866) Pfam (PF07714) In PDB | Homo sapiens (Human) | Proto-oncogene c-Mer,Receptor tyrosine kinase MerTK |
| 2 | A, B | 3-[4-[6-chloranyl-5-[[(3R)-pyrrolidin-3-yl]amino]-1H-indazol-3-yl]pyrazol-1-yl]benzenecarbonitrile | non-polymer | 403.9 | 2 | Chemie (E56) | |||
| 3 | water | water | 18.0 | 1 | Chemie (HOH) |
Sequence modifications
A, B: 570 - 864 (UniProt: Q12866)
| PDB | External Database | Details |
|---|---|---|
| Ser 569 | - | expression tag |
| Met 650 | Ile 650 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 68096.9 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 807.7 | |
| All* | Total formula weight | 68904.6 |
