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Ensemble refinement model

PDB 4MGA|dpdb_2oiy8kcm

Ensemble refinement model

Crystal structure of hERa-LBD (Y537S) in complex with 4-tert-octylphenol

Program
PHENIX 2.0_5824
Model type
Ensemble
Purpose
Refinement
Atoms
209,004
Residues
491
Protein chains
4
Alternate-location fraction
0%
Ligands
27L, CSO

Evaluations

R-work
0.172
R-free
0.211
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Estrogen receptor255
  • Constructligand binding domain (UNP residues 302-552)
  • MutationY537S
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
Estrogen receptor255
  • Constructligand binding domain (UNP residues 302-552)
  • MutationY537S
Entity 3
MoleculeChainsLengthOrganismUniProtDetails
Nuclear receptor coactivator 113
  • Constructcoactivator peptide SRC-1 (UNP residues 686-698)

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations