Browse entries in the PDBbind-CN Database

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Related entries of code: 4rpn
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4rpoRCSB PDB    PDBbind223aa, >4RPO_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1y4zRCSB PDB    PDBbindPCI

Entry Information
PDB ID4rpn
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NamePCP degradation transcriptional activation protein PcpR
Ligand NamePCI
EC.Number E.C.-.-.-.-
Resolution 2.27(Å)
Affinity (Kd/Ki/IC50)Kd=110nM
Release Year2014
Protein/NA SequenceCheck fasta file
Primary Reference (2014) Int J Mol Sci Vol. 15: pp. 20736-20752
Ligand Properties
Formula C6HCl5O
Molecular Weight 266.337
Exact Mass 263.847
No. of atoms 13
No. of bonds 13
Polar Surface Area 20.23
LOGP Value 4.71      (Computed with XLOGP3)
4.66      (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: 1
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): P52679  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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