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5DIE

Crystal Structure of the ER-alpha Ligand-binding Domain in complex with a trifluoro-substituted A-CD ring estrogen derivative (1S,3aR,5S,7aS)-7a-methyl-5-(2,3,5-trifluoro-4-hydroxyphenyl)octahydro-1H-inden-1-ol

Functional Information from PDB Data
site_idAC1
Number of Residues12
Detailsbinding site for residue 5CJ A 601
ChainResidue
AMET343
AGLY521
AHIS524
AHOH718
ALEU346
ALEU349
AALA350
AGLU353
ALEU387
AMET388
ALEU391
AARG394

site_idAC2
Number of Residues12
Detailsbinding site for residue 5CJ B 601
ChainResidue
BLEU346
BLEU349
BALA350
BGLU353
BLEU387
BMET388
BLEU391
BARG394
BMET421
BGLY521
BHIS524
BHOH707

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsMOD_RES: Phosphoserine => ECO:0007744|PubMed:23186163, ECO:0007744|PubMed:24275569
ChainResidueDetails
CSER699
DSER699
AHIS524
BGLU353
BARG394
BHIS524

site_idSWS_FT_FI2
Number of Residues2
DetailsMOD_RES: Phosphotyrosine; by Tyr-kinases => ECO:0000269|PubMed:7539106
ChainResidueDetails
ASER537
BSER537

site_idSWS_FT_FI3
Number of Residues2
DetailsLIPID: S-palmitoyl cysteine => ECO:0000250
ChainResidueDetails
ACYS447
BCYS447

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PDB entries from 2024-11-06

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