Deposited model

PDB 5TM8|dpdb_fvbv6i5j

Deposited model

Crystal Structure of the ER-alpha Ligand-binding Domain (Y537S) in Complex with the OBHS-ASC compound, 7-(4-((1R,4S,6R)-6-((4-bromophenoxy)sulfonyl)-3-(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hept-2-en-2-yl)phenoxy)heptanoic acid

Program
PHENIX 1.10.1_2155
Model type
Deposited
Purpose
Reference
Authors
Nwachukwu, J.C., Erumbi, R., Srinivasan, S., Bruno, N.E., Nowak, J., Izard, T., Kojetin, D.J., Elemento, O., Katzenellenbogen, J.A., Nettles, K.W.
Atoms
4,040
Residues
484
Protein chains
4
Unmodeled fraction
10.37%

Evaluations

R-work
0.190
R-free
0.222
Clashscore
3.7

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Estrogen receptor257
  • Constructligand-binding domain, UNP residues 125-381
  • MutationY537S
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
Nuclear receptor coactivator 213
  • ConstructNuclear receptor-interacting peptide, UNP residues 686-698

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations