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Related entries of code: 1h6h
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
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID1h6h
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Nameneutrophil cytosol factor 4
Ligand NamePIB
EC.Number E.C.-.-.-.-
Resolution 1.7(Å)
Affinity (Kd/Ki/IC50)Kd=5.0uM
Release Year2001
Protein/NA SequenceCheck fasta file
Primary Reference Mol.Cell v8 pp. 829-39, 2001
Ligand Properties
Formula C17H34O16P2
Molecular Weight 556.390
Exact Mass 556.132
No. of atoms 69
No. of bonds 69
Polar Surface Area 289.54
LOGP Value -4.10      (Computed with XLOGP3)
-2.40      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 11
No. of Rotatable Bonds: 19
No. of Nitrogen and Oxygen Atoms: 16
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): Q15080  
Entrez Gene IDNCBI Entrez Gene ID: 4689  
ASDInformation of known allosteric effects of PDB entries

 
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