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Related entries of code: 4lsj
Entries with 90% protein sequence similarity cutoff in PDBbind
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Complexes with the same small molecule ligand
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No complexes with the same small molecule ligand are found!
Entry Information
PDB ID4lsj
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameGlucocorticoid Receptor Ligand Binding Domain
Ligand NameLSJ
EC.Number E.C.-.-.-.-
Resolution 2.35(Å)
Affinity (Kd/Ki/IC50)Ki=0.268nM
Release Year2014
Protein/NA SequenceCheck fasta file
Primary Reference (2014) J.Med.Chem. Vol. 57: pp. 849-860
Ligand Properties
Formula C25H25NO4S
Molecular Weight 435.535
Exact Mass 435.150
No. of atoms 56
No. of bonds 59
Polar Surface Area 73.01
LOGP Value 4.98      (Computed with XLOGP3)
6.48      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 4
Canonical SMILES
InChI String

Links to External Databases
RCSB PDBThe mother database
PDBsumEnhanced annotations on PDB entries
PubchemComprehensive collection of chemical and biological data
UniProtKB ACUniProt accession number (AC): P04150  
Entrez Gene IDNCBI Entrez Gene ID: 2908  
ASDInformation of known allosteric effects of PDB entries
 
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