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Related entries of code: 4u2y
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3zstRCSB PDB    PDBbind695aa, >3ZST_1|Chains... *
5vsjRCSB PDB    PDBbind663aa, >5VSJ_1|Chains... at 99%
5vt4RCSB PDB    PDBbind663aa, >5VT4_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID4u2y
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namevariant Streptomyces coelicolor GlgEI (Sco GlgEI-V279S)
Ligand NameRZM
EC.Number E.C.2.4.99.16
Resolution 2.48(Å)
Affinity (Kd/Ki/IC50)IC50=102uM
Release Year2015
Protein/NA SequenceCheck fasta file
Primary Reference (2015) Sci Rep Vol. 5: pp. 12830-12830
Ligand Properties
Formula C12H24NO9
Molecular Weight 326.320
Exact Mass 326.145
No. of atoms 46
No. of bonds 47
Polar Surface Area 176.68
LOGP Value -3.94      (Computed with XLOGP3)
-4.60      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 8
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 12
No. of Nitrogen and Oxygen Atoms: 10
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): Q9L1K2  
Entrez Gene IDNCBI Entrez Gene ID: 1100883  
ASDInformation of known allosteric effects of PDB entries

 
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