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Related entries of code: 1nhz
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
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Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
2w8yRCSB PDB    PDBbind486

Entry Information
PDB ID1nhz
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Namehuman Glucocorticoid Receptor (N517D, F602S, C638D mutation)
Ligand Name486
EC.Number E.C.-.-.-.-
Resolution 2.3(Å)
Affinity (Kd/Ki/IC50)Ki=0.84uM
Release Year2003
Protein/NA SequenceCheck fasta file
Primary Reference(2010) Bioorg. Med. Chem., Vol.18, pp.4255-4268
Ligand Properties
Formula C29H35NO2
Molecular Weight 429.594
Exact Mass 429.267
No. of atoms 67
No. of bonds 71
Polar Surface Area 40.54
LOGP Value 3.77      (Computed with XLOGP3)
5.41      (Computed with Open Babel)
Drug likenessNo. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 5
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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