6YX0
Crystal structure of SHANK1 PDZ in complex with a peptide-small molecule hybrid
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 12 |
| Details | binding site for Di-peptide PWQ C 901 and THR C 802 |
| Chain | Residue |
| A | VAL677 |
| C | ARG803 |
| C | LEU804 |
| D | PWQ901 |
| A | LEU678 |
| A | ARG679 |
| A | HIS735 |
| B | GLY680 |
| B | ALA681 |
| B | LYS682 |
| B | ALA683 |
| B | HOH916 |
| site_id | AC2 |
| Number of Residues | 10 |
| Details | binding site for Di-peptide PWQ D 901 and THR D 802 |
| Chain | Residue |
| B | VAL677 |
| B | LEU678 |
| B | ARG679 |
| B | HIS735 |
| B | ARG736 |
| B | ARG743 |
| B | HOH944 |
| C | PWQ901 |
| D | ARG803 |
| D | LEU804 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 2 |
| Details | Modified residue: {"description":"Phosphoserine","evidences":[{"source":"UniProtKB","id":"D3YZU1","evidenceCode":"ECO:0000250"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 94 |
| Details | Domain: {"description":"PDZ","evidences":[{"source":"PROSITE-ProRule","id":"PRU00143","evidenceCode":"ECO:0000255"}]} |
| Chain | Residue | Details |
