8DUG
Estrogen Receptor Alpha Ligand Binding Domain in Complex with (6'-hydroxy-1'-(4-(2-((S)-3-methylpyrrolidin-1-yl)ethoxy)phenyl)-1',4'-dihydro-2'H-spiro[cyclopropane-1,3'-isoquinolin]-2'-yl)(phenyl)methanone
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) | Estrogen receptor | polymer | 255 | 29033.0 | 2 | UniProt (P03372) Pfam (PF00104) | Homo sapiens (human) | |
2 | C, D (A, B) | [(1'R)-6'-hydroxy-1'-(4-{2-[(3R)-3-methylpyrrolidin-1-yl]ethoxy}phenyl)-1',4'-dihydro-2'H-spiro[cyclopropane-1,3'-isoquinolin]-2'-yl](phenyl)methanone | non-polymer | 482.6 | 2 | Chemie (TVF) | |||
3 | E, F (A, B) | water | water | 18.0 | 141 | Chemie (HOH) |
Sequence modifications
A, B: 301 - 554 (UniProt: P03372)
PDB | External Database | Details |
---|---|---|
Met 300 | - | initiating methionine |
Ser 381 | Cys 381 | engineered mutation |
Ser 417 | Cys 417 | engineered mutation |
Ser 530 | Cys 530 | engineered mutation |
Ser 536 | Leu 536 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 58066.0 | |
Non-Polymers* | Number of molecules | 2 |
Total formula weight | 965.2 | |
All* | Total formula weight | 59031.3 |