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Related entries of code: 4a4e
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4a4gRCSB PDB    PDBbind64aa, >4A4G_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
4a4fRCSB PDB    PDBbind2MR

Entry Information
PDB ID4a4e
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameTudor domain of SURVIVAL MOTOR NEURON PROTEIN
Ligand Name2MR
EC.Number E.C.-.-.-.-
Resolution NMR
Affinity (Kd/Ki/IC50)Kd=0.476mM
Release Year2011
Protein/NA SequenceCheck fasta file
Primary Reference (2011) Nat.Struct.Mol.Biol. Vol. 18: pp. 1414
Ligand Properties
Formula C8H20N4O2
Molecular Weight 204.270
Exact Mass 204.159
No. of atoms 34
No. of bonds 33
Polar Surface Area 102.97
LOGP Value -2.84      (Computed with XLOGP3)
-2.88      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 0
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): Q16637  
Entrez Gene IDNCBI Entrez Gene ID: 6606  6607  
ASDInformation of known allosteric effects of PDB entries

 
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