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Related entries of code: 1ws4
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1ugwRCSB PDB    PDBbind20aa, >1UGW_2|Chains... *
1ugxRCSB PDB    PDBbind20aa, >1UGX_2|Chain... at 95%
1ugyRCSB PDB    PDBbind20aa, >1UGY_2|Chains... at 100%
1ws5RCSB PDB    PDBbind20aa, >1WS5_2|Chains... at 95%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID1ws4
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Nameagglutinin alpha chain
Ligand NameGYP
EC.Number E.C.-.-.-.-
Resolution 1.9(Å)
Affinity (Kd/Ki/IC50)Kd=1.00mM
Release Year2005
Protein/NA SequenceCheck fasta file
Primary Reference J.Mol.Biol. v347 pp. 181-8, 2005
Ligand Properties
Formula C7H14O6
Molecular Weight 194.182
Exact Mass 194.079
No. of atoms 27
No. of bonds 27
Polar Surface Area 99.38
LOGP Value -2.05      (Computed with XLOGP3)
-2.57      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 6
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): P18670  P18673  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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