Browse entries in the PDBbind-CN Database

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Related entries of code: 6cnj
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4ocxRCSB PDB    PDBbind216aa, >4OCX_2|Chain... at 96%
5jopRCSB PDB    PDBbind219aa, >5JOP_1|Chains... at 91%
6cnkRCSB PDB    PDBbind238aa, >6CNK_3|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1uw6RCSB PDB    PDBbindNCT
2yk1RCSB PDB    PDBbindNCT
5kxiRCSB PDB    PDBbindNCT
6cnkRCSB PDB    PDBbindNCT
5o87RCSB PDB    PDBbindNCT
Entry Information
PDB ID6cnj
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameNeuronal acetylcholine receptor subunit alpha-4
Ligand NameNCT
EC.Number E.C.-.-.-.-
Resolution 3.4(Å)
Affinity (Kd/Ki/IC50)Kd=7.7nM
Release Year2018
Protein/NA SequenceCheck fasta file
Primary Reference (2018) Nature Vol. 557: pp. 261-265
Ligand Properties
Formula C10H15N2
Molecular Weight 163.239
Exact Mass 163.124
No. of atoms 27
No. of bonds 28
Polar Surface Area 17.33
LOGP Value 1.21      (Computed with XLOGP3)
2.00      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 2
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): P17787  P43681  
Entrez Gene IDNCBI Entrez Gene ID: 1141  1137  
ASDInformation of known allosteric effects of PDB entries
 
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