Structure analysis

Human estrogen receptor alpha ligand-binding domain in complex with compound 11F

X-ray diffraction
1.6Å resolution
Source organism: Homo sapiens
Assembly composition:
homo dimer (preferred)
Entry contents: 1 distinct polypeptide molecule

Assemblies

Assembly 1 (preferred)
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Multimeric state: homo dimer
Accessible surface area: 22046.81 Å2
Buried surface area: 5547.53 Å2
Dissociation area: 1,569.8 Å2
Dissociation energy (ΔGdiss): 14.73 kcal/mol
Dissociation entropy (TΔSdiss): 13.42 kcal/mol
Symmetry number: 2
PDBe Complex ID: PDB-CPX-136919
    Assembly 1
Confidence : 98%
No. subunits : 2
Symmetry : C2
3DComplex & QSbio predictionx
No. subunits : 2
Symmetry : C2

Macromolecules

Chain: A
Length: 246 amino acids
Theoretical weight: 28.13 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli
UniProt:
  • Canonical: P03372 (Residues: 309-554; Coverage: 41%)
Gene names: ESR, ESR1, NR3A1
Pfam: Ligand-binding domain of nuclear hormone receptor
InterPro:
CATH: Retinoid X Receptor
SCOP: Nuclear receptor ligand-binding domain
PDBe-KB: UniProt Coverage View: P03372  
124620406080100120140160180200220240
 
100200
UniProt
P03372
Chains
Domains
Secondary structure
Flexibility predictions
Early folding residue predictions
Ligand binding sites
Interaction interfaces

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