5TM9
Crystal Structure of the ER-alpha Ligand-binding Domain (Y537S) in Complex with the OBHS-ASC Analog, (E)-3-(4-((1R,4S,6R)-6-((3-chlorophenoxy)sulfonyl)-3-(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hept-2-en-2-yl)phenyl)acrylic acid
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 12 |
| Details | binding site for residue 7KL A 601 |
| Chain | Residue |
| A | LEU346 |
| A | ILE424 |
| A | GLY521 |
| A | HOH727 |
| A | THR347 |
| A | ALA350 |
| A | GLU353 |
| A | LEU387 |
| A | MET388 |
| A | ARG394 |
| A | PHE404 |
| A | MET421 |
| site_id | AC2 |
| Number of Residues | 4 |
| Details | binding site for residue 7KL A 602 |
| Chain | Residue |
| A | PHE337 |
| A | GLN414 |
| A | HOH701 |
| A | HOH750 |
| site_id | AC3 |
| Number of Residues | 13 |
| Details | binding site for residue 7KL A 603 |
| Chain | Residue |
| A | TYR331 |
| A | ASP332 |
| A | PRO333 |
| A | ARG335 |
| A | PRO336 |
| A | PHE337 |
| A | SER338 |
| A | SER341 |
| A | MET342 |
| A | ASN407 |
| A | GLN414 |
| A | 7KL604 |
| A | HOH720 |
| site_id | AC4 |
| Number of Residues | 13 |
| Details | binding site for residue 7KL A 604 |
| Chain | Residue |
| A | TYR331 |
| A | ASP332 |
| A | PRO333 |
| A | ARG335 |
| A | PRO336 |
| A | PHE337 |
| A | SER338 |
| A | SER341 |
| A | MET342 |
| A | ASN407 |
| A | GLN414 |
| A | 7KL603 |
| A | HOH720 |
| site_id | AC5 |
| Number of Residues | 12 |
| Details | binding site for residue 7KL B 601 |
| Chain | Residue |
| B | MET343 |
| B | ALA350 |
| B | GLU353 |
| B | LEU387 |
| B | MET388 |
| B | LEU391 |
| B | ARG394 |
| B | MET421 |
| B | ILE424 |
| B | GLY521 |
| B | HIS524 |
| B | HOH719 |
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 | 8 |
| Details | Motif: {"description":"LXXLL motif 2"} |
| Chain | Residue | Details |
