4TV1
Crystal structure of hERa-LBD (Y537S) in complex with propylparaben
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 3 |
| Details | binding site for residue 36M A 601 |
| Chain | Residue |
| A | GLU353 |
| A | LEU387 |
| A | ARG394 |
| site_id | AC2 |
| Number of Residues | 6 |
| Details | binding site for residue GOL A 602 |
| Chain | Residue |
| A | TYR331 |
| A | ASN407 |
| A | LEU408 |
| A | LEU409 |
| A | GLN414 |
| A | HOH798 |
| site_id | AC3 |
| Number of Residues | 3 |
| Details | binding site for residue GOL A 603 |
| Chain | Residue |
| A | GLU323 |
| A | TRP393 |
| A | GLY442 |
| site_id | AC4 |
| Number of Residues | 5 |
| Details | binding site for residue EDO A 604 |
| Chain | Residue |
| A | GLU419 |
| A | GLY420 |
| A | VAL422 |
| A | GLU423 |
| A | HOH746 |
| site_id | AC5 |
| Number of Residues | 3 |
| Details | binding site for residue EDO A 605 |
| Chain | Residue |
| A | TYR526 |
| A | HIS547 |
| A | ARG548 |
| site_id | AC6 |
| Number of Residues | 6 |
| Details | binding site for residue PEG A 606 |
| Chain | Residue |
| A | MET438 |
| A | ASN439 |
| A | GLN441 |
| A | GLU444 |
| A | MET490 |
| A | ALA493 |
| site_id | AC7 |
| Number of Residues | 8 |
| Details | binding site for residue GOL A 607 |
| Chain | Residue |
| A | LYS529 |
| A | ASN532 |
| A | VAL534 |
| A | PRO535 |
| A | LEU536 |
| A | HOH701 |
| A | HOH717 |
| A | HOH720 |
| site_id | AC8 |
| Number of Residues | 3 |
| Details | binding site for residue 36M B 601 |
| Chain | Residue |
| B | GLU353 |
| B | ARG394 |
| B | LEU525 |
| site_id | AC9 |
| Number of Residues | 3 |
| Details | binding site for residue GOL B 602 |
| Chain | Residue |
| B | GLU323 |
| B | TRP393 |
| B | GOL603 |
| site_id | AD1 |
| Number of Residues | 9 |
| Details | binding site for residue GOL B 603 |
| Chain | Residue |
| B | GLU323 |
| B | ILE326 |
| B | GLY390 |
| B | ARG394 |
| B | PHE445 |
| B | LYS449 |
| B | GOL602 |
| B | HOH732 |
| B | HOH792 |
| site_id | AD2 |
| Number of Residues | 4 |
| Details | binding site for residue PEG B 604 |
| Chain | Residue |
| B | GLU444 |
| B | LEU489 |
| B | ALA493 |
| B | HOH773 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 6 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"9338790","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"9600906","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1A52","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1ERE","evidenceCode":"ECO:0007744"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 2 |
| Details | Lipidation: {"description":"S-palmitoyl cysteine","evidences":[{"evidenceCode":"ECO:0000250"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 1 |
| Details | Modified residue: {"description":"Phosphotyrosine; by Tyr-kinases","evidences":[{"source":"PubMed","id":"7539106","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI4 |
| Number of Residues | 8 |
| Details | Motif: {"description":"LXXLL motif 4"} |
| Chain | Residue | Details |
