Browse entries in the PDBbind-CN Database

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Related entries of code: 3rf4
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3rf5RCSB PDB    PDBbind116aa, >3RF5_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1z9yRCSB PDB    PDBbindFUN
2xn5RCSB PDB    PDBbindFUN

Entry Information
PDB ID3rf4
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameAncylostoma ceylanicum mif
Ligand NameFUN
EC.Number E.C.-.-.-.-
Resolution 1.8(Å)
Affinity (Kd/Ki/IC50)Ki=0.56uM
Release Year2011
Protein/NA SequenceCheck fasta file
Primary Reference (2011) Chem.Biol. Vol. 18: pp. 1089-1101
Ligand Properties
Formula C12H11ClN2O5S
Molecular Weight 330.744
Exact Mass 330.008
No. of atoms 32
No. of bonds 33
Polar Surface Area 131.01
LOGP Value 2.86      (Computed with XLOGP3)
3.74      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 7
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): A4GRE3  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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