4X3J
Selection of fragments for kinase inhibitor design: decoration is key
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A | Angiopoietin-1 receptor | polymer | 321 | 36794.0 | 1 | UniProt (Q02763) Pfam (PF07714) In PDB | Homo sapiens (Human) | Endothelial tyrosine kinase,Tunica interna endothelial cell kinase,Tyrosine kinase with Ig and EGF homology domains-2,Tyrosine-protein kinase receptor TEK,Tyrosine-protein kinase receptor TIE-2,hTIE2,p140 TEK |
| 2 | A | 1-[4-(4-amino-5-oxopyrido[2,3-d]pyrimidin-8(5H)-yl)phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]urea | non-polymer | 458.4 | 1 | Chemie (3WR) | |||
| 3 | water | water | 18.0 | 17 | Chemie (HOH) |
Sequence modifications
A: 802 - 1122 (UniProt: Q02763)
| PDB | External Database | Details |
|---|---|---|
| Asn 964 | Asp 964 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 36794.0 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 458.4 | |
| All* | Total formula weight | 37252.4 |
