Browse entries in the PDBbind-CN Database

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Related entries of code: 3n23
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4resRCSB PDB    PDBbind65aa, >4RES_3|Chains... *
4retRCSB PDB    PDBbind65aa, >4RET_3|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1ibgRCSB PDB    PDBbindOBN
3a3yRCSB PDB    PDBbindOBN
Entry Information
PDB ID3n23
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameSodium/potassium-transporting ATPase, subunit alpha-1, E2P form
Ligand NameOBN
EC.Number E.C.3.6.3.9
Resolution 4.6(Å)
Affinity (Kd/Ki/IC50)Kd=3nM
Release Year2011
Protein/NA SequenceCheck fasta file
Primary Reference (2011) J.Struct.Biol.
Ligand Properties
Formula C29H44O12
Molecular Weight 584.652
Exact Mass 584.283
No. of atoms 85
No. of bonds 90
Polar Surface Area 206.6
LOGP Value -1.98      (Computed with XLOGP3)
-1.52      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 8
No. of Hydrogen Bond Acceptors: 9
No. of Rotatable Bonds: 12
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 6
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): P05024  P05027  Q58K79  
Entrez Gene IDNCBI Entrez Gene ID: 397481  396898  541593  
ASDInformation of known allosteric effects of PDB entries
 
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