Browse entries in the PDBbind-CN Database

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Related entries of code: 4p6x
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1osvRCSB PDB    PDBbind12aa, >1OSV:E|PDBID|CHAIN|... at 100%
1p93RCSB PDB    PDBbind12aa, >1P93:H|PDBID|CHAIN|... at 100%
1t63RCSB PDB    PDBbind14aa, >1T63:B|PDBID|CHAIN|... at 100%
2ao6RCSB PDB    PDBbind25aa, >2AO6:B|PDBID|CHAIN|... *
3k22RCSB PDB    PDBbind12aa, >3K22:H|PDBID|CHAIN|... at 100%
3k23RCSB PDB    PDBbind12aa, >3K23:F|PDBID|CHAIN|... at 100%
3l0eRCSB PDB    PDBbind12aa, >3L0E:B|PDBID|CHAIN|... at 100%
4csjRCSB PDB    PDBbind13aa, >4CSJ:B|PDBID|CHAIN|... at 100%
4p6wRCSB PDB    PDBbind12aa, >4P6W:B|PDBID|CHAIN|... at 91%
5h1eRCSB PDB    PDBbind13aa, >5H1E:C|PDBID|CHAIN|... at 100%
5ickRCSB PDB    PDBbind11aa, >5ICK:D|PDBID|CHAIN|... at 100%
5q17RCSB PDB    PDBbind12aa, >5Q17:B|PDBID|CHAIN|... at 100%
5xplRCSB PDB    PDBbind13aa, >5XPL:C|PDBID|CHAIN|... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
2v95RCSB PDB    PDBbindHCY
5hgcRCSB PDB    PDBbindHCY

Entry Information
PDB ID4p6x
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameGlucocorticoid receptor GR LBD
Ligand NameHCY
EC.Number E.C.-.-.-.-
Resolution 2.5(Å)
Affinity (Kd/Ki/IC50)Ki=91nM
Release Year2014
Protein/NA SequenceCheck fasta file
Primary Reference (2014) Cell Res. Vol. 24: pp. 713-726
Ligand Properties
Formula C21H30O5
Molecular Weight 362.460
Exact Mass 362.209
No. of atoms 56
No. of bonds 59
Polar Surface Area 94.83
LOGP Value 1.61      (Computed with XLOGP3)
1.78      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 5
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  Q15596  
Entrez Gene IDNCBI Entrez Gene ID: 2908  10499  
ASDInformation of known allosteric effects of PDB entries

 
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