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Related entries of code: 4re4
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4re2RCSB PDB    PDBbind503aa, >4RE2_1|Chain... *
4re3RCSB PDB    PDBbind503aa, >4RE3_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1oifRCSB PDB    PDBbindIFM
2g9vRCSB PDB    PDBbindIFM
2nsxRCSB PDB    PDBbindIFM
4iicRCSB PDB    PDBbindIFM

Entry Information
PDB ID4re4
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameBeta-mannosidase/beta-glucosidase, GH1 Os7BGlu26
Ligand NameIFM
EC.Number E.C.3.2.1.25
Resolution 2.29(Å)
Affinity (Kd/Ki/IC50)Ki=135nM
Release Year2015
Protein/NA SequenceCheck fasta file
Primary Reference (2015) ACS CATALYSIS Vol. 5: pp. 6041-6051
Ligand Properties
Formula C6H14NO3
Molecular Weight 148.180
Exact Mass 148.097
No. of atoms 24
No. of bonds 24
Polar Surface Area 77.3
LOGP Value -1.54      (Computed with XLOGP3)
-1.54      (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: 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): A2YPH1  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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