5HHW
Crystal structure of insulin receptor kinase domain in complex with cis-(R)-7-(3-(azetidin-1-ylmethyl)cyclobutyl)-5-(3-((tetrahydro-2H-pyran-2-yl)methoxy)phenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine.
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Insulin receptor | polymer | 307 | 34939.0 | 1 | UniProt (P06213) Pfam (PF07714) | Homo sapiens (Human) | IR |
| 2 | B (A) | 7-[3-(azetidin-1-ylmethyl)cyclobutyl]-5-[3-[[(2~{R})-oxan-2-yl]methoxy]phenyl]pyrrolo[2,3-d]pyrimidin-4-amine | non-polymer | 447.6 | 1 | Chemie (60O) | |||
| 3 | C (A) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 1 | Chemie (EDO) | |||
| 4 | D (A) | water | water | 18.0 | 320 | Chemie (HOH) |
Sequence modifications
A: 1005 - 1310 (UniProt: P06213)
| PDB | External Database | Details |
|---|---|---|
| Met 1004 | - | initiating methionine |
| Ser 1008 | Cys 1008 | engineered mutation |
| Asn 1159 | Asp 1159 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 34939.0 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 509.6 | |
| All* | Total formula weight | 35448.7 |
