Browse entries in the PDBbind-CN Database

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Related entries of code: 3e5u
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2h6bRCSB PDB    PDBbind250aa, >2H6B_1|Chains... *
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
2h6bRCSB PDB    PDBbind3C4
Entry Information
PDB ID3e5u
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameCyclic nucleotide-binding protein(C200S)
Ligand Name3C4
EC.Number E.C.-.-.-.-
Resolution 1.83(Å)
Affinity (Kd/Ki/IC50)Kd=1.4uM
Release Year2008
Protein/NA SequenceCheck fasta file
Primary Reference (2008) Mol.Microbiol. Vol. 70: pp. 151-167
Ligand Properties
Formula C8H7ClO3
Molecular Weight 186.592
Exact Mass 186.008
No. of atoms 19
No. of bonds 19
Polar Surface Area 57.53
LOGP Value 3.10      (Computed with XLOGP3)
1.67      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 1
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): B8FW11  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
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