Browse entries in the PDBbind-CN Database

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Related entries of code: 3w9k
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
3uevRCSB PDB    PDBbindMYR
3usxRCSB PDB    PDBbindMYR
3v2nRCSB PDB    PDBbindMYR
4tkhRCSB PDB    PDBbindMYR
Entry Information
PDB ID3w9k
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameFATTY ACID-BINDING PROTEIN
Ligand NameMYR
EC.Number E.C.-.-.-.-
Resolution 1.8(Å)
Affinity (Kd/Ki/IC50)Kd=0.48uM
Release Year2013
Protein/NA SequenceCheck fasta file
Primary Reference (2013) J.Bacteriol.Vol. 195: pp. 4005鈥4012.
Ligand Properties
Formula C14H28O2
Molecular Weight 228.371
Exact Mass 228.209
No. of atoms 44
No. of bonds 43
Polar Surface Area 37.3
LOGP Value 7.48      (Computed with XLOGP3)
4.77      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 0
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): Q973T5  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
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