8B5Y
SHP2 in complex with allosteric imidazopyrazine inhibitor
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (A, B) | Tyrosine-protein phosphatase non-receptor type 11 | polymer | 526 | 60305.0 | 2 | UniProt (Q06124) Pfam (PF00017) Pfam (PF00102) | Homo sapiens (human) | Protein-tyrosine phosphatase 1D,PTP-1D,Protein-tyrosine phosphatase 2C,PTP-2C,SH-PTP2,SHP-2,Shp2,SH-PTP3 |
| 2 | C, Q (A, B) | (1~{S})-1'-[5-[2-(trifluoromethyl)pyridin-3-yl]sulfanyl-3~{H}-imidazo[4,5-b]pyrazin-2-yl]spiro[1,3-dihydroindene-2,4'-piperidine]-1-amine | non-polymer | 497.5 | 2 | Chemie (P8O) | |||
| 3 | D, E, F, G, H... (A, B) | FORMIC ACID | non-polymer | 46.0 | 22 | Chemie (FMT) | |||
| 4 | AA, BA (A, B) | water | water | 18.0 | 844 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 525 (UniProt: Q06124)
| PDB | External Database | Details |
|---|---|---|
| Gly 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 120610.0 | |
| Non-Polymers* | Number of molecules | 24 |
| Total formula weight | 2007.6 | |
| All* | Total formula weight | 122617.6 |
