6YX1
Crystal structure of SHANK1 PDZ in complex with a peptide-small molecule hybrid
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | SH3 and multiple ankyrin repeat domains protein 1 | polymer | 112 | 12341.3 | 2 | UniProt (Q9Y566) Pfam (PF17820) In PDB | Homo sapiens (Human) | Shank1,Somatostatin receptor-interacting protein,SSTRIP |
2 | A, B | 2-[[2-(5-oxidanylidenepentanoyl)hydrazinyl]methyl]benzoic acid | non-polymer | 264.3 | 2 | Chemie (PWT) | |||
3 | A, B | THREONINE | non-polymer | 119.1 | 2 | Chemie (THR) | |||
4 | A, B | ARGININE | non-polymer | 175.2 | 2 | Chemie (ARG) | |||
5 | A, B | LEUCINE | non-polymer | 131.2 | 2 | Chemie (LEU) | |||
6 | water | water | 18.0 | 113 | Chemie (HOH) |
Sequence modifications
A, B: 654 - 762 (UniProt: Q9Y566)
PDB | External Database | Details |
---|---|---|
Gly 651 | - | expression tag |
Pro 652 | - | expression tag |
Leu 653 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 24682.6 | |
Non-Polymers* | Number of molecules | 8 |
Total formula weight | 1379.6 | |
All* | Total formula weight | 26062.1 |