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Related entries of code: 4at3
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4at4RCSB PDB    PDBbind299aa, >4AT4_1|Chain... at 100%
4at5RCSB PDB    PDBbind299aa, >4AT5_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 ID4at3
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameBDNF/NT-3 GROWTH FACTORS RECEPTOR, TRKB KINASE DOMAIN
Ligand NameLTI
EC.Number E.C.2.7.10.1
Resolution 1.77(Å)
Affinity (Kd/Ki/IC50)IC50=0.004uM
Release Year2012
Protein/NA SequenceCheck fasta file
Primary Reference (2012) J.Mol.Biol. Vol. 423: pp. 439-453
Ligand Properties
Formula C16H18N4O2S2
Molecular Weight 362.470
Exact Mass 362.087
No. of atoms 42
No. of bonds 44
Polar Surface Area 164.64
LOGP Value 3.01      (Computed with XLOGP3)
4.77      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 3
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): Q16620  
Entrez Gene IDNCBI Entrez Gene ID: 4915  
ASDInformation of known allosteric effects of PDB entries
 
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