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Kauppi, B., Bonn, T.To be published.
4ZI1
HUMAN ESTROGEN RECEPTOR BETA LIGAND-BINDING DOMAIN IN COMPLEX WITH KB095285 AND CIA12 COACTIVATOR PEPTIDE
- PDB DOI: https://doi.org/10.2210/pdb4ZI1/pdb
- Classification: SIGNALING PROTEIN
- Organism(s): Homo sapiens
- Expression System: Escherichia coli
- Mutation(s): Yes
- Deposited: 2015-04-27 Released: 2016-06-29
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 2.10 Å
- R-Value Free: 0.223
- R-Value Work: 0.175
- R-Value Observed: 0.177
This is version 1.0 of the entry. See complete history.
Literature
Macromolecules
Find similar proteins by:
(by identity cutoff) | 3D Structure
Entity ID: 1 | |||||
|---|---|---|---|---|---|
| Molecule | Chains | Sequence Length | Organism | Details | Image |
| Estrogen receptor beta | 249 | Homo sapiens | Mutation(s): 0 Gene Names: ESR2, ESTRB, NR3A2 |  | |
UniProt & NIH Common Fund Data Resources | |||||
Find proteins for Q92731 (Homo sapiens) Explore Q92731 Go to UniProtKB: Q92731 | |||||
PHAROS: Q92731 GTEx: ENSG00000140009 | |||||
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
| UniProt Group | Q92731 | ||||
Sequence AnnotationsExpand | |||||
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Find similar proteins by: Sequence | 3D Structure
Entity ID: 2 | |||||
|---|---|---|---|---|---|
| Molecule | Chains | Sequence Length | Organism | Details | Image |
| Nuclear receptor coactivator 5 | 12 | Homo sapiens | Mutation(s): 2 |  | |
UniProt & NIH Common Fund Data Resources | |||||
Find proteins for Q9HCD5 (Homo sapiens) Explore Q9HCD5 Go to UniProtKB: Q9HCD5 | |||||
PHAROS: Q9HCD5 GTEx: ENSG00000124160 | |||||
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
| UniProt Group | Q9HCD5 | ||||
Sequence AnnotationsExpand | |||||
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Small Molecules
| Ligands 1 Unique | |||||
|---|---|---|---|---|---|
| ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
| KB0 Query on KB0 | C [auth A] | 2-(4-hydroxyphenyl)-7-methyl-3-phenyl-1H-inden-5-ol C22 H18 O2 KXVQYSIZQKFFIZ-UHFFFAOYSA-N |  | ||
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 2.10 Å
- R-Value Free: 0.223
- R-Value Work: 0.175
- R-Value Observed: 0.177
- Space Group: I 41
Unit Cell:
| Length ( Å ) | Angle ( ˚ ) |
|---|---|
| a = 85.258 | α = 90 |
| b = 85.258 | β = 90 |
| c = 112.14 | γ = 90 |
| Software Name | Purpose |
|---|---|
| MOSFLM | data reduction |
| SCALA | data scaling |
| MOLREP | phasing |
| REFMAC | refinement |
| TRUNCATE | data scaling |
Entry History
Deposition Data
- Released Date: 2016-06-29 Deposition Author(s): Kauppi, B., Bonn, T.
Revision History (Full details and data files)
- Version 1.0: 2016-06-29
Type: Initial release
