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Related entries of code: 4ufl
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4ccdRCSB PDB    PDBbind654aa, >4CCD_1|Chain... *
4ufhRCSB PDB    PDBbind654aa, >4UFH_1|Chain... at 100%
4ufiRCSB PDB    PDBbind654aa, >4UFI_1|Chain... at 100%
4ufjRCSB PDB    PDBbind654aa, >4UFJ_1|Chain... at 100%
4ufkRCSB PDB    PDBbind654aa, >4UFK_1|Chain... at 100%
4ufmRCSB PDB    PDBbind654aa, >4UFM_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID4ufl
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameMouse Galactocerebrosidase
Ligand NameDZX
EC.Number E.C.3.2.1.46
Resolution 2.4(Å)
Affinity (Kd/Ki/IC50)Ki=2.3mM
Release Year2015
Protein/NA SequenceCheck fasta file
Primary Reference (2015) Chem.Sci. Vol. 6: pp. 3075-3089
Ligand Properties
Formula C8H16NO3
Molecular Weight 174.218
Exact Mass 174.113
No. of atoms 28
No. of bonds 29
Polar Surface Area 77.3
LOGP Value -0.92      (Computed with XLOGP3)
-1.01      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 4
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): P54818  
Entrez Gene IDNCBI Entrez Gene ID: 14420  
ASDInformation of known allosteric effects of PDB entries

 
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